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4897-31-8

4897-31-8 structure
4897-31-8 structure
  • Name: Chlomizole
  • Chemical Name: 4-chloro-1-methyl-5-nitroimidazole
  • CAS Number: 4897-31-8
  • Molecular Formula: C4H4ClN3O2
  • Molecular Weight: 161.54600
  • Create Date: 2017-05-16 16:12:07
  • Modify Date: 2024-01-05 20:53:18

Name 4-chloro-1-methyl-5-nitroimidazole
Synonyms 4-Chlor-1-methyl-5-nitro-1H-imidazol
1-Methyl-4-chlor-5-nitro-imidazol
4-chloro-1-methyl-5-nitro-1H-imidazole
Khlomizol
Chloronizole
1H-Imidazole,4-chloro-1-methyl-5-nitro
Imidazole,4-chloro-1-methyl-5-nitro
Chlomizole
1-methyl-4-chloro-5-nitroimidazole
Density 1.65g/cm3
Boiling Point 362.3ºC at 760 mmHg
Molecular Formula C4H4ClN3O2
Molecular Weight 161.54600
Flash Point 172.9ºC
Exact Mass 160.99900
PSA 63.64000
LogP 1.50490
Index of Refraction 1.648
Storage condition 2-8°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI4397000
CHEMICAL NAME :
Imidazole, 4-chloro-1-methyl-5-nitro-
CAS REGISTRY NUMBER :
4897-31-8
BEILSTEIN REFERENCE NO. :
0144324
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C4-H4-Cl-N3-O2
MOLECULAR WEIGHT :
161.56
WISWESSER LINE NOTATION :
T5N CNJ A1 DG ENW

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 :
275 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 31,158,1968

~80%

4897-31-8 structure

4897-31-8

Literature: Samant, Bhupesh S.; Sukhthankar, Mugdha G. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 3 p. 1015 - 1018

~40%

4897-31-8 structure

4897-31-8

Literature: Suwinski, Jerzy; Salwinska, Ewa; Watras, Jan; Widel, Maria Polish Journal of Chemistry, 1982 , vol. 56, # 10-12 p. 1261 - 1272

~11%

4897-31-8 structure

4897-31-8

Literature: Suwinski, Jerzy; Salwinska, Ewa; Watras, Jan; Widel, Maria Polish Journal of Chemistry, 1982 , vol. 56, # 10-12 p. 1261 - 1272

~%

4897-31-8 structure

4897-31-8

Literature: Sarasin; Wegmann Helvetica Chimica Acta, 1924 , vol. 7, p. 714