3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile

Modify Date: 2025-09-30 11:13:34

3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile Structure
3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile structure
 Common Name 3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile
CAS Number 110592-13-7 Molecular Weight 212.22900
Density 1.43g/cm3 Boiling Point 536.2ºC at 760 mmHg
Molecular Formula C7H8N4O2S Melting Point N/A
MSDS N/A Flash Point 278.1ºC

 Names

Name 3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.43g/cm3
Boiling Point 536.2ºC at 760 mmHg
Molecular Formula C7H8N4O2S
Molecular Weight 212.22900
Flash Point 278.1ºC
Exact Mass 212.03700
PSA 123.59000
LogP 2.15528
Vapour Pressure 1.43E-11mmHg at 25°C
Index of Refraction 1.606

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ4957000
CHEMICAL NAME :
Propanenitrile, 3-((1-methyl-4-nitro-1H-imidazol-5-yl)thio)-
CAS REGISTRY NUMBER :
110592-13-7
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H8-N4-O2-S
MOLECULAR WEIGHT :
212.25

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 21,403,1987

 Synonyms

3-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)propanenitrile
Propanenitrile,3-((2-methyl-5-nitro-1H-imidazol-4-yl)thio)
3-((2-Methyl-4-nitro-1H-imidazol-5-yl)thio)propanenitrile
Propanenitrile,3-((1-methyl-4-nitro-1H-imidazol-5-yl)thio)
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Chemsrc provides CAS#:110592-13-7 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile>> amp version: 3-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]propanenitrile

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