(2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide

Modify Date: 2025-10-14 13:16:39

(2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide Structure
(2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide structure
 Common Name (2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide
CAS Number 161692-87-1 Molecular Weight 407.45200
Density 1.181g/cm3 Boiling Point 585.8ºC at 760 mmHg
Molecular Formula C25H23F2NO2 Melting Point N/A
MSDS N/A Flash Point 308.1ºC

 Names

Name (2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.181g/cm3
Boiling Point 585.8ºC at 760 mmHg
Molecular Formula C25H23F2NO2
Molecular Weight 407.45200
Flash Point 308.1ºC
Exact Mass 407.17000
PSA 49.66000
LogP 6.55840
Vapour Pressure 1.05E-13mmHg at 25°C
Index of Refraction 1.563
InChIKey IRODEYFFQWPTPR-DLBZAZTESA-N
SMILES CC(CC(=O)c1ccc(-c2ccc(F)cc2F)cc1)C(=O)NC(C)c1ccccc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DV1753640
CHEMICAL NAME :
(1,1'-Biphenyl)-4-butanamide, 2',4'-difluoro-alpha-methyl-gamma-oxo-N-(1-phenylethy l)-, (R-(R*,S*))-
CAS REGISTRY NUMBER :
161692-87-1
LAST UPDATED :
199603
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C25-H23-F2-N-O2
MOLECULAR WEIGHT :
407.49

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 59,2705,1994

 Synonyms

R-(+)-1-Phenylethylamide of 4-(2',4'-difluorobiphenyl-4-yl)-2-methyl-4-oxobutanoic acid
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Chemsrc provides CAS#:161692-87-1 MSDS, density, melting point, boiling point, structure, etc. Its name is (2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide>> amp version: (2S)-4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-N-[(1R)-1-phenylethyl]butanamide

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