2-(2-methyl-5-nitroimidazol-1-yl)ethyl methanesulfonate

Names

[ CAS No. ]:
30746-54-4

[ Name ]:
2-(2-methyl-5-nitroimidazol-1-yl)ethyl methanesulfonate

[Synonym ]:
2-Methyl-5-nitro-1H-imidazole-1-ethyl methanesulfonate
My 40.20
2-Methyl-5-nitro-1H-imidazole-1-ethyl methanesulphonate
metronidazole methanesulfonate
EINECS 250-323-8

Chemical & Physical Properties

[ Density]:
1.53g/cm3

[ Boiling Point ]:
522.6ºC at 760mmHg

[ Molecular Formula ]:
C7H11N3O5S

[ Molecular Weight ]:
249.24400

[ Flash Point ]:
269.9ºC

[ Exact Mass ]:
249.04200

[ PSA ]:
115.39000

[ LogP ]:
1.67990

[ Index of Refraction ]:
1.6

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI5635000
CHEMICAL NAME :
Imidazole-1-ethanol, 2-methyl-5-nitro-, methanesulfonate (ester)
CAS REGISTRY NUMBER :
30746-54-4
BEILSTEIN REFERENCE NO. :
0542838
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H11-N3-O5-S
MOLECULAR WEIGHT :
249.27

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
17 umol/L
REFERENCE :
TCMUD8 Teratogenesis, Carcinogenesis, and Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1980- Volume(issue)/page/year: 3,51,1983

Safety Information

[ HS Code ]:
2933290090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Methanesulfonyl chloride
  • Metronidazole

DownStream

  • 1-(2-BROMO-ETHYL)-2-METHYL-5-NITRO-1H-IMIDAZOLE
  • 1-(2-Iodoethyl)-2-methyl-5-nitro-1H-imidazole
  • 2-(2-methyl-5-nitroimidazol-1-yl)ethanethiol
  • 1-(2-azidoethyl)-2-methyl-5-nitro-imidazole

Customs

[ HS Code ]: 2933290090

[ Summary ]:
2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%