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

Names

[ CAS No. ]:
110578-98-8

[ Name ]:
2-[(2-methyl-5-nitro-1H-imidazol-4-yl)sulfanyl]acetamide

[Synonym ]:
Acetamide,2-[(2-methyl-4-nitro-1H-imidazol-5-yl)thio]
Acetamide,2-((2-methyl-5-nitro-1H-imidazol-4-yl)thio)
2-Methyl-4(5)-nitroimidazole-5(4)-thioacetic amide
(2-Methyl-4-nitroimidazol-5-thio)acetamide

Chemical & Physical Properties

[ Density]:
1.56g/cm3

[ Boiling Point ]:
590.5ºC at 760 mmHg

[ Molecular Formula ]:
C6H8N4O3S

[ Molecular Weight ]:
216.21800

[ Flash Point ]:
310.9ºC

[ Exact Mass ]:
216.03200

[ PSA ]:
143.88000

[ LogP ]:
1.87660

[ Vapour Pressure ]:
6.39E-14mmHg at 25°C

[ Index of Refraction ]:
1.645

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AC6281000
CHEMICAL NAME :
Acetamide, 2-((2-methyl-4-nitro-1H-imidazol-5-yl)thio)-
CAS REGISTRY NUMBER :
110578-98-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H8-N4-O3-S
MOLECULAR WEIGHT :
216.24

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1250 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

Synthetic Route

Precursor & DownStream

Precursor

  • 2-Chloroacetamide

DownStream

  • 2-[(2-methyl-4-nitro-1H-imidazol-5-yl)sulfonyl]acetamide