Methyl 4-((2-acetylphenyl)amino)-4-oxobutanoate

Modify Date: 2025-09-23 23:52:31

Methyl 4-((2-acetylphenyl)amino)-4-oxobutanoate Structure
Methyl 4-((2-acetylphenyl)amino)-4-oxobutanoate structure
Common Name Methyl 4-((2-acetylphenyl)amino)-4-oxobutanoate
CAS Number 41242-36-8 Molecular Weight 249.26200
Density 1.203g/cm3 Boiling Point 450.8ºC at 760 mmHg
Molecular Formula C13H15NO4 Melting Point N/A
MSDS N/A Flash Point 226.4ºC

 Names

Name methyl 4-(2-acetylanilino)-4-oxobutanoate

 Chemical & Physical Properties

Density 1.203g/cm3
Boiling Point 450.8ºC at 760 mmHg
Molecular Formula C13H15NO4
Molecular Weight 249.26200
Flash Point 226.4ºC
Exact Mass 249.10000
PSA 72.47000
LogP 1.85390
Index of Refraction 1.552
InChIKey DAGKPVMCRDOMSU-UHFFFAOYSA-N
SMILES COC(=O)CCC(=O)Nc1ccccc1C(C)=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EK7713326
CHEMICAL NAME :
Butanoic acid, 4-((2-acetylphenyl)amino)-4-oxo-, methyl ester
CAS REGISTRY NUMBER :
41242-36-8
LAST UPDATED :
199803
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H15-N-O4
MOLECULAR WEIGHT :
249.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRXXBL French Demande Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2121391
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