1-methyl-4-nitroimidazole

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Names

[ CAS No. ]:
3034-41-1

[ Name ]:
1-methyl-4-nitroimidazole

[Synonym ]:
Imidazole,1-methyl-4-nitro
1-methyl-4-nitro-1H-imidazole
1H-Imidazole,1-methyl-4-nitro
N-methyl-4-nitroimidazole
1-methyl-4-nitroimidazol
1-Methyl-4-nitro-1H-imidazol

Chemical & Physical Properties

[ Density]:
1.44g/cm3

[ Boiling Point ]:
328.9ºC at 760mmHg

[ Melting Point ]:
136 °C

[ Molecular Formula ]:
C4H5N3O2

[ Molecular Weight ]:
127.10100

[ Flash Point ]:
152.7ºC

[ Exact Mass ]:
127.03800

[ PSA ]:
63.64000

[ LogP ]:
0.85150

[ Index of Refraction ]:
1.618

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI7525000
CHEMICAL NAME :
Imidazole, 1-methyl-4-nitro-
CAS REGISTRY NUMBER :
3034-41-1
BEILSTEIN REFERENCE NO. :
0123533
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C4-H5-N3-O2
MOLECULAR WEIGHT :
127.12
WISWESSER LINE NOTATION :
T5N CNJ A1 DNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Klebsiella pneumoniae
DOSE/DURATION :
2 mmol/L/20H
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 66,207,1979

Safety Information

[ Hazard Codes ]:
Xi

[ HS Code ]:
2933290090

Synthetic Route

Precursor & DownStream

Precursor

  • 4-Nitroimidazole
  • methyl iodide
  • Dimethyl Carbonate
  • Dimethyl oxalate
  • cis-bis(ethylenediamine)(N-methylimidazole)chlorocobalt(III)(2+)
  • Dimethyl sulfate
  • methylimidazole
  • 1,4-dinitroimidazole
  • methylamine

DownStream

  • Sarcosine
  • Ammonia
  • methylamine
  • 1-methyl-4,5-dinitro-imidazole
  • Imidazolium, 1,3-dimethyl-4-nitro-, iodide
  • 2,6-DICHLORO-N-(1-METHYL-1H-IMIDAZOL-4-YL)PYRIMIDIN-4-AMINE
  • 1-Methyl-1H-imidazol-4-amine
  • 1-Methyl-1H-imidazol-4-amine hydrochloride (1:1)
  • 2-(benzenesulfonylmethyl)-4-chloro-1-nitrobenzene

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%


Related Compounds

  • 2-iodo-1-methyl-4-nitroimidazole
  • 5-iodo-1-methyl-4-nitroimidazole
  • 1-methyl-4-nitroimidazole-5-thiol
  • 5-cyano-1-methyl-4-nitroimidazole
  • 5-bromo-1-methyl-4-nitroimidazole
  • 2-bromo-1-methyl-4-nitroimidazole