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Home > Encyclopedia > 2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE

2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE

2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE structure

2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE 

structure
  • CAS No:

    19225-92-4

  • Formula:

    C5H7ClN2

  • Chemical Name:

    2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE

  • Synonyms:

    2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE;AKOS BBS-00005326;1-Methyl-2-(chloromethyl)imidazole;2-(Chloromethyl)-N-methylimidazole;2-Chloromethyl-1-methylimidazole;2-(ChloroMethyl)-1-Methyl-1H-iMidazole, >95%;1H-Imidazole,2-(chloromethyl)-1-methyl-

2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE Basic Attributes

130.58

130.029770

DTXSID00353063

2933290090

Characteristics

17.8

0.4

1.2

182-184°C

244℃

101℃

1.551

0.0493mmHg at 25°C

Safety Information

IRRITANT

Xi

P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, P501

H314

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-(CHLOROMETHYL)-1-METHYL-1H-IMIDAZOLE Use and Manufacturing

To 1.12 g of 1-methyl-2-imidazolemethanol are added dropwise 1.8 ml of thionyl chloride at 0° C. ^-ChloromethyM-methyl-I H-imidazole] (14)To a solution of compound 13 (250 mg, 2.23 mmol) in chloroform (5 mL) was added thionyl chloride (500 mg, 4.20 mmol) and refluxed for 3 h. The reaction mixture was allowed to come to room temperature and concentrated. The reaction mixture was diluted with diethyl ether (30 mL) and concentrated. The crude product 14 (200 mg, 67percent) was characterized by GC-MS and it was used as such for the next step.

Computed Properties

Molecular Weight:130.57
XLogP3:0.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:130.0297759
Monoisotopic Mass:130.0297759
Topological Polar Surface Area:17.8
Heavy Atom Count:8
Complexity:76.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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