2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone

Modify Date: 2025-08-26 12:04:36

2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone Structure
2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone structure
Common Name 2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone
CAS Number 73932-11-3 Molecular Weight 232.30100
Density 1.19g/cm3 Boiling Point 474.4ºC at 760 mmHg
Molecular Formula C12H12N2OS Melting Point N/A
MSDS N/A Flash Point 240.7ºC

 Names

Name 2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone

 Chemical & Physical Properties

Density 1.19g/cm3
Boiling Point 474.4ºC at 760 mmHg
Molecular Formula C12H12N2OS
Molecular Weight 232.30100
Flash Point 240.7ºC
Exact Mass 232.06700
PSA 60.19000
LogP 2.48790
Index of Refraction 1.616
InChIKey XOCANYCBIQEMJX-UHFFFAOYSA-N
SMILES CSc1ccc(C(=O)Cn2ccnc2)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM9225030
CHEMICAL NAME :
Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-
CAS REGISTRY NUMBER :
73932-11-3
LAST UPDATED :
198606
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H12-N2-O-S
MOLECULAR WEIGHT :
232.32
WISWESSER LINE NOTATION :
T5N CNJ A1VR DS1

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 :
240 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 120,383,1981
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