1-(2-chloroethyl)-2-methyl-5-nitro-imidazol

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Names

[ CAS No. ]:
13182-81-5

[ Name ]:
1-(2-chloroethyl)-2-methyl-5-nitro-imidazol

[Synonym ]:
unii-8a2r934d6a
f2124-0724

Chemical & Physical Properties

[ Density]:
1.45g/cm3

[ Boiling Point ]:
364.8ºC at 760 mmHg

[ Molecular Formula ]:
C6H8ClN3O2

[ Molecular Weight ]:
189.60000

[ Flash Point ]:
174.4ºC

[ Exact Mass ]:
189.03100

[ PSA ]:
63.64000

[ LogP ]:
1.86170

[ Vapour Pressure ]:
3.44E-05mmHg at 25°C

[ Index of Refraction ]:
1.604

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI4389000
CHEMICAL NAME :
Imidazole, 1-(2-chloroethyl)-2-methyl-5-nitro-
CAS REGISTRY NUMBER :
13182-81-5
BEILSTEIN REFERENCE NO. :
0611685
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H8-Cl-N3-O2
MOLECULAR WEIGHT :
189.62
WISWESSER LINE NOTATION :
T5N CNJ A2G B1 ENW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,167,1968

Safety Information

[ HS Code ]:
2933290090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Metronidazole
  • ethyl 2-bromoacetate

DownStream

  • N-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]phthalimide
  • 1-(2-Iodoethyl)-2-methyl-5-nitro-1H-imidazole
  • 1-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]pyridin-1-ium,chloride
  • 2-methyl-1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]-5-nitroimidazole,chloride
  • sodium,4-methylpiperazine-1-carbodithioate

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

  • 1-[2-(2-methyl-5-nitro-imidazol-1-yl)-ethyl]-piperidin-4-ol
  • 4,4-dimethyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)-ethyl]-piperidine-2,6-dione
  • Chlorure de <(methyl-2 nitro-5 imidazol-1-yl)-2 ethyl>-1 t-butyl-4 pyridinium
  • 1-dimethylcarbamoyloxy-2-(2-methyl-5-nitro-imidazol-1-yl)-ethane
  • 1-(2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl)piperidin-4-one
  • 1-(2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl)piperazine
  • (4-(Benzo[d]thiazol-2-yl)piperazin-1-yl)(5-methylisoxazol-3-yl)methanone
  • 1-(1,3,6-Trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-5-yl)piperidine-4-carboxamide
  • 5-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
  • 4-methyl-6-(2-oxo-2-(pyrrolidin-1-yl)ethyl)-1-(o-tolyl)-1H-pyrazolo[3,4-d]pyridazin-7(6H)-one
  • Ethyl 3-[4-chloro-3,5-bis(1-methylpyrazol-4-yl)pyrazol-1-yl]propanoate
  • 2-((6-(3-Methoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)thio)-1-(4-phenylpiperazin-1-yl)ethanone
  • 2-cyclohexyl-N-(3-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl)acetamide
  • N-(4-methoxybenzo[d]thiazol-2-yl)-3-(phenylthio)-N-(pyridin-3-ylmethyl)propanamide
  • N-(4-methoxy-7-methylbenzo[d]thiazol-2-yl)-3-(phenylthio)-N-(pyridin-3-ylmethyl)propanamide
  • 1-(1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-5-oxopyrrolidin-3-yl)-3-(3-phenylpropyl)urea
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