Doxycycline Hydrochloride CAS#: 10592-13-9

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline Hydrochloride
分子结构
CAS编号 10592-13-9
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride
分子式 C22H24N2O8 : HCl
分子量 444.4 : 36.5
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C1=O)[C@@]2([H])[C@H](C3=CC=CC(O)=C13)C)(C4=O)[C@]([C@H]2O)([H])[C@@H](C(O)=C4C(N)=O)N(C)C.Cl

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 564-25-0 (Free base) ; 17086-28-1 (hydrate)
Use Pattern
Doxycycline Hydrochloride is chemically (4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride. Doxycycline Hydrochloride is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline Hydrochloride can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

N-Desmethyl Doxycycline CAS#: 86271-83-2

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 N-Desmethyl Doxycycline
分子结构
CAS编号 86271-83-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-3,5,10,12,12a-Pentahydroxy-6-methyl-4-(methylamino)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
分子式 C21H22N2O8
分子量 430.4
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C1=O)[C@@]2([H])[C@H](C3=CC=CC(O)=C13)C)(C4=O)[C@@]([C@@H](C(O)=C4C(N)=O)NC)([H])[C@H]2O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
N-Desmethyl Doxycycline is chemically (4S,4aR,5S,5aR,6R,12aS)-3,5,10,12,12a-Pentahydroxy-6-methyl-4-(methylamino)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide. N-Desmethyl Doxycycline is supplied with detailed characterization data compliant with regulatory guideline. N-Desmethyl Doxycycline can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

N-Nitroso 2-acetyl-2-decarbamoyldoxycycline CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 N-Nitroso 2-acetyl-2-decarbamoyldoxycycline
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-((1S,4aS,11R,11aR,12S,12aR)-3-acetyl-2,4a,5,7,12-pentahydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-1-yl)-N-methylnitrous amide
分子式 C22H22N2O9
分子量 458.4
InChI
InChI Key
Canonical SMILES O=C1C(C(C)=O)=C(O)[C@@H](N(N=O)C)[C@@]2([H])[C@]1(O)C(O)=C(C(C3=C(O)C=CC=C3[C@@H]4C)=O)[C@]4([H])[C@@H]2O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
N-Nitroso 2-acetyl-2-decarbamoyldoxycycline is chemically N-((1S,4aS,11R,11aR,12S,12aR)-3-acetyl-2,4a,5,7,12-pentahydroxy-11-methyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-1-yl)-N-methylnitrous amide. N-Nitroso 2-acetyl-2-decarbamoyldoxycycline is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso 2-acetyl-2-decarbamoyldoxycycline can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Doxycycline-13CD3 CAS#: 1902958-13-7

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline-13CD3
分子结构
CAS编号 1902958-13-7
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-3,5,10,12,12a-Pentahydroxy-6-methyl-4-(methyl(methyl-13C-d3)amino)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
分子式 C2113CH21D3N2O8
分子量 448.5
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C(C1=C2O)=O)[C@]([C@H](C1=CC=C2)C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(C)[13C]([2H])([2H])[2H]

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Doxycycline-13CD3 is chemically (4S,4aR,5S,5aR,6R,12aS)-3,5,10,12,12a-Pentahydroxy-6-methyl-4-(methyl(methyl-13C-d3)amino)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide. Doxycycline-13CD3 is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline-13CD3 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Doxycycline D3 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline D3
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-(methyl-d)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-4,6-d2-2-carboxamide
分子式 C22H21D3N2O8
分子量 447.5
InChI
InChI Key
Canonical SMILES O=C(C1=C(O)[C@](N(C)C)([2H])[C@@]([C@@H](O)[C@@]2([H])C(C(C3=C(O)C=CC=C3C2([2H])C[2H])=O)=C4O)([H])[C@@]4(O)C1=O)N

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Doxycycline D3 is chemically (4S,4aR,5S,5aR,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-(methyl-d)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-4,6-d2-2-carboxamide. Doxycycline D3 is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline D3 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Doxycycline Hyclate CAS#: 24390-14-5

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline Hyclate
分子结构
CAS编号 24390-14-5
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride hemiethanol hemihydrate
分子式 C22H24N2O8 : 1/2(C2H6O) : HCl : 1/2(H2O)
分子量 444.4 : 1/2(46.1) : 36.5 : 1/2(18.0)
InChI
InChI Key
Canonical SMILES CCO.O[C@@](C(O)=C(C(C1=C2C=CC=C1O)=O)[C@]([C@H]2C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(C)C.Cl.[1/2H2O]

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Doxycycline Hyclate is chemically (4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride hemiethanol hemihydrate. It is also known as Doxycycline Hydrochloride Hemiethanol Hemihydrate ; . Doxycycline Hyclate is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline Hyclate can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

N-Nitroso-N-Desmethyl Doxycycline CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 N-Nitroso-N-Desmethyl Doxycycline
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-3,5,10,12,12a-pentahydroxy-6-methyl-4-(methyl(nitroso)amino)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
分子式 C21H21N3O9
分子量 459.4
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C(C1=C2C=CC=C1O)=O)[C@]([C@H]2C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(N=O)C

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
N-Nitroso-N-Desmethyl Doxycycline is chemically (4S,4aR,5S,5aR,6R,12aS)-3,5,10,12,12a-pentahydroxy-6-methyl-4-(methyl(nitroso)amino)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide. N-Nitroso-N-Desmethyl Doxycycline is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso-N-Desmethyl Doxycycline can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Doxycycline CAS#: 564-25-0

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline
分子结构
CAS编号 564-25-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
分子式 C22H24N2O8
分子量 444.4
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C(C1=C2C=CC=C1O)=O)[C@]([C@H]2C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(C)C

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 10592-13-9 (hydrochloride) ; 17086-28-1 (hydrate)
Use Pattern
Doxycycline is chemically (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide. Doxycycline is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Doxycycline D6 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline D6
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6R,12aS)-4-(Bis(methyl-d3)amino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
分子式 C22H18D6N2O8
分子量 450.5
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C(C1=C2C=CC=C1O)=O)[C@]([C@H]2C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(C([2H])([2H])[2H])C([2H])([2H])[2H]

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 564-25-0 (Unlabeled)
Use Pattern
Doxycycline D6 is chemically (4S,4aR,5S,5aR,6R,12aS)-4-(Bis(methyl-d3)amino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide. Doxycycline D6 is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline D6 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Doxycycline EP Impurity A (HCl) CAS#: 41411-66-9

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Doxycycline EP Impurity A (HCl)
分子结构
CAS编号 41411-66-9
EINECS Number
MDL Number
Beilstein Registry Number
别名 (4S,4aR,5S,5aR,6S,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride
分子式 C22H24N2O8 : HCl
分子量 444.4 : 36.5
InChI
InChI Key
Canonical SMILES O[C@@](C(O)=C(C(C1=C2C=CC=C1O)=O)[C@]([C@@H]2C)([H])[C@@H]3O)(C(C(C(N)=O)=C4O)=O)[C@]3([H])[C@@H]4N(C)C.Cl

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 3219-99-6 (free base)
Use Pattern
Doxycycline EP Impurity A (HCl) is chemically (4S,4aR,5S,5aR,6S,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride. It is also known as Doxycycline USP Related Ccompound A ; 6-Epidoxycyline Hydrochloride. Doxycycline EP Impurity A (HCl) is supplied with detailed characterization data compliant with regulatory guideline. Doxycycline EP Impurity A (HCl) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Doxycycline. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.