Posaconazole Hydroxy Triazole CAS#: 79538-90-2

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

Identification

英文名 Posaconazole Hydroxy Triazole
分子结构
CAS编号 79538-90-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(4-(4-Hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
分子式 C18H19N5O2
分子量 337.4
InChI
InChI Key
Canonical SMILES O=C1N(C=NN1)C2=CC=C(N3CCN(C(C=C4)=CC=C4O)CC3)C=C2

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 1638923-19-9 (sodium salt)
Use Pattern
Posaconazole Hydroxy Triazole is chemically 4-(4-(4-(4-Hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one. Posaconazole Hydroxy Triazole is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Hydroxy Triazole 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 Posaconazole. 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.

Posaconazole Impurity 107 CAS#: 2723886-21-1

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

Identification

英文名 Posaconazole Impurity 107
分子结构
CAS编号 2723886-21-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 (R)-4-(2,4-difluorophenyl)-2-(hydroxymethyl)pent-4-en-1-yl isobutyrate
分子式 C16H20F2O3
分子量 298.3
InChI
InChI Key
Canonical SMILES FC1=C(C(C[C@@H](COC(C(C)C)=O)CO)=C)C=CC(F)=C1

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
Posaconazole Impurity 107 is chemically (R)-4-(2,4-difluorophenyl)-2-(hydroxymethyl)pent-4-en-1-yl isobutyrate. Posaconazole Impurity 107 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 107 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 Posaconazole. 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.

Posaconazole Formyl Semicarbazide Analog CAS#: 1350560-57-4

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

Identification

英文名 Posaconazole Formyl Semicarbazide Analog
分子结构
CAS编号 1350560-57-4
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-formyl-1-((2S,3S)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide
分子式 C37H44F2N8O5
分子量 718.8
InChI
InChI Key
Canonical SMILES O=C(N([C@@H](CC)[C@@H](O)C)NC=O)NC1=CC=C(N2CCN(C3=CC=C(OC[C@@H]4CO[C@](C5=CC=C(F)C=C5F)(CN6N=CN=C6)C4)C=C3)CC2)C=C1

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
Posaconazole Formyl Semicarbazide Analog is chemically N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-formyl-1-((2S,3S)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide. Posaconazole Formyl Semicarbazide Analog is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Formyl Semicarbazide Analog 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 Posaconazole. 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.

Posaconazole Impurity 98 CAS#: N/A

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

Identification

英文名 Posaconazole Impurity 98
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-(2-((4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)amino)ethyl)-N-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)formamide
分子式 C36H40F2N8O5
分子量 702.8
InChI
InChI Key
Canonical SMILES O=CN(CCNC1=CC=C(OC[C@@H]2CO[C@](C3=CC=C(F)C=C3F)(CN4N=CN=C4)C2)C=C1)C5=CC=C(N6C=NN([C@@H](CC)[C@@H](O)C)C6=O)C=C5

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
Posaconazole Impurity 98 is chemically N-(2-((4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)amino)ethyl)-N-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)formamide. Posaconazole Impurity 98 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 98 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 Posaconazole. 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.

Posaconazole Impurity 93 CAS#: N/A

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

Identification

英文名 Posaconazole Impurity 93
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(((2S,4R)-2-(2,4-difluorophenyl)-4-((trityloxy)methyl)tetrahydrofuran-2-yl)methyl)-1H-1,2,4-triazole
分子式 C33H29F2N3O2
分子量 537.6
InChI
InChI Key
Canonical SMILES FC(C=C1)=CC(F)=C1[C@]2(CN3C=NC=N3)C[C@H](COC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)CO2

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
Posaconazole Impurity 93 is chemically 1-(((2S,4R)-2-(2,4-difluorophenyl)-4-((trityloxy)methyl)tetrahydrofuran-2-yl)methyl)-1H-1,2,4-triazole. Posaconazole Impurity 93 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 93 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 Posaconazole. 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.

Posaconazole Impurity 112 CAS#: 165115-73-1

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

Identification

英文名 Posaconazole Impurity 112
分子结构
CAS编号 165115-73-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-(2-(2,4-Difluorophenyl)allyl)propane-1,3-diol
分子式 C12H14F2O2
分子量 228.2
InChI
InChI Key
Canonical SMILES OCC(CC(C1=CC=C(F)C=C1F)=C)CO

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
Posaconazole Impurity 112 is chemically 2-(2-(2,4-Difluorophenyl)allyl)propane-1,3-diol. Posaconazole Impurity 112 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 112 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 Posaconazole. 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.

Posaconazole Impurity 87 CAS#: N/A

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

Identification

英文名 Posaconazole Impurity 87
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2S,3S)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide
分子式 C36H44F2N8O4
分子量 690.8
InChI
InChI Key
Canonical SMILES FC1=CC(F)=CC=C1[C@](C2)(CN3C=NC=N3)OC[C@H]2COC4=CC=C(C=C4)N5CCN(C6=CC=C(NC(N(N)[C@@H](CC)[C@@H](O)C)=O)C=C6)CC5

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
Posaconazole Impurity 87 is chemically N-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-1-((2S,3S)-2-hydroxypentan-3-yl)hydrazine-1-carboxamide. Posaconazole Impurity 87 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 87 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 Posaconazole. 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.

Posaconazole Impurity 109 CAS#: N/A

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

Identification

英文名 Posaconazole Impurity 109
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2-fluoro-4-(1H-1,2,4-triazol-1-yl)phenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-((2S,3S)-2-(benzyloxy)pentan-3-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
分子式 C46H50FN11O4
分子量 840.0
InChI
InChI Key
Canonical SMILES O=C1N([C@H]([C@@H](OCC2=CC=CC=C2)C)CC)N=CN1C(C=C3)=CC=C3N(CC4)CCN4C5=CC=C(OC[C@@H]6CO[C@](C7=CC=C(N8N=CN=C8)C=C7F)(CN9N=CN=C9)C6)C=C5

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
Posaconazole Impurity 109 is chemically 4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2-fluoro-4-(1H-1,2,4-triazol-1-yl)phenyl)tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-((2S,3S)-2-(benzyloxy)pentan-3-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one. Posaconazole Impurity 109 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 109 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 Posaconazole. 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.

Posaconazole Impurity 113 CAS#: N/A

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

Identification

英文名 Posaconazole Impurity 113
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-(2-(Benzyloxy)pentan-3-yl)-5-ethyl-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
分子式 C32H39N5O3
分子量 541.7
InChI
InChI Key
Canonical SMILES OC1=CC=C(N2CCN(C3=CC=C(N4C(CC)=NN(C(CC)C(C)OCC5=CC=CC=C5)C4=O)C=C3)CC2)C=C1

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
Posaconazole Impurity 113 is chemically 2-(2-(Benzyloxy)pentan-3-yl)-5-ethyl-4-(4-(4-(4-hydroxyphenyl)piperazin-1-yl)phenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one. Posaconazole Impurity 113 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 113 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 Posaconazole. 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.

Posaconazole Impurity 95 CAS#: N/A

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

Identification

英文名 Posaconazole Impurity 95
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(4-((2R,4R)-2-((1H-1,2,4-triazol-1-yl)methyl)-4-((trityloxy)methyl)tetrahydrofuran-2-yl)-3-fluorophenyl)-1H-1,2,4-triazole
分子式 C35H31FN6O2
分子量 586.7
InChI
InChI Key
Canonical SMILES FC1=CC(N2N=CN=C2)=CC=C1[C@]3(CN4N=CN=C4)OC[C@@H](COC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C3

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
Posaconazole Impurity 95 is chemically 1-(4-((2R,4R)-2-((1H-1,2,4-triazol-1-yl)methyl)-4-((trityloxy)methyl)tetrahydrofuran-2-yl)-3-fluorophenyl)-1H-1,2,4-triazole. Posaconazole Impurity 95 is supplied with detailed characterization data compliant with regulatory guideline. Posaconazole Impurity 95 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 Posaconazole. 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.