Neotame Impurity 2 CAS#: 223113-38-0

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

Identification

英文名 Neotame Impurity 2
分子结构
CAS编号 223113-38-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 (S)-3-(Bis(3,3-dimethylbutyl)amino)-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoic acid
分子式 C26H42N2O5
分子量 462.6
InChI
InChI Key
Canonical SMILES CC(C)(C)CCN(CCC(C)(C)C)[C@@]([H])(CC(O)=O)C(N[C@](CC1=CC=CC=C1)([H])C(OC)=O)=O

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
Neotame Impurity 2 is chemically (S)-3-(Bis(3,3-dimethylbutyl)amino)-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoic acid. Neotame Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. Neotame Impurity 2 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 Neotame. 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.

Neotame USP Related Compound A CAS#: 190910-14-6

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

Identification

英文名 Neotame USP Related Compound A
分子结构
CAS编号 190910-14-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-[N-(3,3-Dimethylbutyl)-l-alpha-aspartyl]-l-phenylalanine (as per USP)
分子式 C19H28N2O5
分子量 364.4
InChI
InChI Key
Canonical SMILES O=C(O)[C@H](CC1=CC=CC=C1)NC([C@H](CC(O)=O)NCCC(C)(C)C)=O

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 212121-67-0 (sodium salt)
Use Pattern
Neotame USP Related Compound A is chemically N-[N-(3,3-Dimethylbutyl)-l-alpha-aspartyl]-l-phenylalanine (as per USP). Neotame USP Related Compound A is supplied with detailed characterization data compliant with regulatory guideline. Neotame USP Related Compound A 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 Neotame. 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.

Neotame Impurity 3 CAS#: 271582-82-2

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

Identification

英文名 Neotame Impurity 3
分子结构
CAS编号 271582-82-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-((2S,4S)-3-(3,3-dimethylbutyl)-1-((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)-2-neopentyl-5-oxoimidazolidin-4-yl)acetic acid
分子式 C26H40N2O5
分子量 460.6
InChI
InChI Key
Canonical SMILES COC([C@@](CC1=CC=CC=C1)([H])N2C([C@@](CC(O)=O)([H])N(CCC(C)(C)C)[C@@H]2CC(C)(C)C)=O)=O

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
Neotame Impurity 3 is chemically 2-((2S,4S)-3-(3,3-dimethylbutyl)-1-((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)-2-neopentyl-5-oxoimidazolidin-4-yl)acetic acid. Neotame Impurity 3 is supplied with detailed characterization data compliant with regulatory guideline. Neotame Impurity 3 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 Neotame. 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.

Neotame Impurity 1 CAS#: N/A

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

Identification

英文名 Neotame Impurity 1
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 Methyl (S)-3-((3,3-dimethylbutyl)amino)-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoate hydrochloride
分子式 C21H32N2O5 : HCl
分子量 392.5 : 36.5
InChI
InChI Key
Canonical SMILES CC(C)(C)CCN[C@@]([H])(CC(OC)=O)C(N[C@](CC1=CC=CC=C1)([H])C(OC)=O)=O.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 271587-72-5 (free base)
Use Pattern
Neotame Impurity 1 is chemically Methyl (S)-3-((3,3-dimethylbutyl)amino)-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoate hydrochloride. Neotame Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Neotame Impurity 1 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 Neotame. 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.

Neotame CAS#: 165450-17-9

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

Identification

英文名 Neotame
分子结构
CAS编号 165450-17-9
EINECS Number
MDL Number
Beilstein Registry Number
别名 (S)-3-((3,3-Dimethylbutyl)amino)-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoic acid
分子式 C20H30N2O5
分子量 378.5
InChI
InChI Key
Canonical SMILES COC([C@@H](NC([C@H](CC(O)=O)NCCC(C)(C)C)=O)CC1=CC=CC=C1)=O

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 243116-62-3 (monohyrate) ; 221151-98-0 (potassium salt)
Use Pattern
Neotame is chemically (S)-3-((3,3-Dimethylbutyl)amino)-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoic acid. Neotame is supplied with detailed characterization data compliant with regulatory guideline. Neotame 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 Neotame. 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.