ChemicalBook--->CAS DataBase List--->118194-41-5

118194-41-5

118194-41-5 Structure

118194-41-5 Structure
IdentificationBack Directory
[Name]

Trandolaprilat Methyl Ester
[CAS]

118194-41-5
[Synonyms]

Trandolapril EP IMpurity A
Trandolaprilat Methyl Ester
Trandolapril Methyl Ester Analog
Trandolapril Impurity 1(Trandolapril EP Impurity A)
Trandolapril Related Compound A(Secondary Standards traceble to USP)
(2S,3aR,7aS)-1-[N-[(S)-1-Carboxy-3-phenylpropyl]-L-alanyl]hexahydro-2-indolinecarboxylic Acid 1-methyl Ester
[2S-[1[R*(R*)],2α,3aα,7aβ]]-Octahydro-1-[2-[[1-(Methoxycarbonyl)-3-phenylpropyl]aMino]-1-oxopropyl]-1H-indole-2-carboxylic Acid
1H-Indole-2-carboxylic acid, octahydro-1-[2-[[1-(methoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-, [2S-[1[R*(R*)],2α,3aα,7aβ]]- (9CI)
[Molecular Formula]

C23H32N2O5
[MDL Number]

MFCD29472431
[MOL File]

118194-41-5.mol
[Molecular Weight]

416.51
Chemical PropertiesBack Directory
[Melting point ]

142-147°C
[Boiling point ]

617.909±55.00 °C(Press: 760.00 Torr)(predicted)
[density ]

1.197±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
[storage temp. ]

Refrigerator
[solubility ]

Chloroform, DMSO, Ethyl Acetate, Methanol
[form ]

Solid
[pka]

3.146±0.20(predicted)
[color ]

White to Off-White
[Major Application]

pharmaceutical (small molecule)
[InChIKey]

QUDOFHJAZMIEDX-ZDNSCYFHSA-N
[SMILES]

N2([C@@H]3[C@@H](C[C@H]2C(=O)O)CCCC3)C(=O)[C@@H](N[C@@H](CCc1ccccc1)C(=O)OC)C
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)
GHS08
[Signal word ]

Danger
[Hazard statements ]

H360D
[Precautionary statements ]

P201-P202-P280-P308+P313-P405-P501
[WGK Germany ]

WGK 3
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Repr. 1B
Hazard InformationBack Directory
[Uses]

Trandolaprilat (T713520) impurity; an antihypertensive.
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