2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone

Modify Date: 2025-09-13 19:17:55

2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone Structure
2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone structure
 Common Name 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone
CAS Number 36065-80-2 Molecular Weight 265.28800
Density 1.47g/cm3 Boiling Point 450.2ºC at 760 mmHg
Molecular Formula C11H11N3O3S Melting Point N/A
MSDS N/A Flash Point 226.1ºC

 Names

Name 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone

 Chemical & Physical Properties

Density 1.47g/cm3
Boiling Point 450.2ºC at 760 mmHg
Molecular Formula C11H11N3O3S
Molecular Weight 265.28800
Flash Point 226.1ºC
Exact Mass 265.05200
PSA 112.58000
LogP 1.75750
Index of Refraction 1.69
InChIKey SFYBVYGDWXFMAJ-UHFFFAOYSA-N
SMILES O=C(CSC1=NCCN1)c1ccc([N+](=O)[O-])cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NJ4385000
CHEMICAL NAME :
2-Imidazoline, 2-(p-nitrophenacylthio)-
CAS REGISTRY NUMBER :
36065-80-2
BEILSTEIN REFERENCE NO. :
0755988
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H11-N3-O3-S

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01745
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Chemsrc provides CAS#:36065-80-2 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone>> amp version: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-1-(4-nitrophenyl)ethanone

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