2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone

Modify Date: 2025-09-09 18:39:32

2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone Structure
2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone structure
 Common Name 2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone
CAS Number 73932-16-8 Molecular Weight 288.40800
Density 1.11g/cm3 Boiling Point 495.8ºC at 760 mmHg
Molecular Formula C16H20N2OS Melting Point N/A
MSDS N/A Flash Point 253.7ºC

 Names

Name 2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone

 Chemical & Physical Properties

Density 1.11g/cm3
Boiling Point 495.8ºC at 760 mmHg
Molecular Formula C16H20N2OS
Molecular Weight 288.40800
Flash Point 253.7ºC
Exact Mass 288.13000
PSA 60.19000
LogP 3.90420
Index of Refraction 1.583
InChIKey VNUKVDIMHZFZRB-UHFFFAOYSA-N
SMILES CC(C)CCSc1ccc(C(=O)Cn2ccnc2)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM9224000
CHEMICAL NAME :
Acetophenone, 2-(1-imidazolyl)-4'-(isopentylthio)-
CAS REGISTRY NUMBER :
73932-16-8
LAST UPDATED :
198606
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C16-H20-N2-O-S
MOLECULAR WEIGHT :
288.44
WISWESSER LINE NOTATION :
T5N CNJ A1VR DS2Y1&1

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 :
750 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
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
420 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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Chemsrc provides CAS#:73932-16-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone>> amp version: 2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone

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