102504-60-9

102504-60-9 structure

102504-60-9 structure

Name: [(1S)-5-amino-1-carboxypentyl]azanium,2-[3-(4-methylbenzoyl)phenoxy]propanoate
Chemical Name: [(1S)-5-amino-1-carboxypentyl]azanium,2-[3-(4-methylbenzoyl)phenoxy]propanoate
CAS Number: 102504-60-9
Molecular Formula: C₂₃H₃₀N₂O₆
Molecular Weight: 430.49400
Create Date: 2016-07-18 09:58:39
Modify Date: 2024-02-03 22:28:39

Name	[(1S)-5-amino-1-carboxypentyl]azanium,2-[3-(4-methylbenzoyl)phenoxy]propanoate
Synonyms	2-(3-(p-Methylbenzoyl)phenoxy)propionic acid lysine salt Propionic acid,2-(3-(p-methylbenzoyl)phenoxy)-,lysine salt

Molecular Formula	C₂₃H₃₀N₂O₆
Molecular Weight	430.49400
Exact Mass	430.21000
PSA	152.94000
LogP	4.00580

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UF5566000

CHEMICAL NAME :: Propionic acid, 2-(3-(p-methylbenzoyl)phenoxy)-, lysine salt

CAS REGISTRY NUMBER :: 102504-60-9

LAST UPDATED :: 198609

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H16-O4.C6-H14-N2-O2

MOLECULAR WEIGHT :: 430.55

WISWESSER LINE NOTATION :: QVY1&OR CVR D1 &Z4YZVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,457,1980