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Home > Encyclopedia > 1-tert-Butyl-1H-imidazole

1-tert-Butyl-1H-imidazole

1-tert-Butyl-1H-imidazole structure

1-tert-Butyl-1H-imidazole 

structure
  • CAS No:

    45676-04-8

  • Formula:

    C7H12N2

  • Chemical Name:

    1-tert-Butyl-1H-imidazole

  • Synonyms:

    1-tert-Butyl-1H-imidazole;1-t-ButyliMidazole;1-tert-Butylimidazole;1-tert-Butylimidazole;1-tert-Butylimidazole,>95%;1H-Imidazole, 1-(1,1-dimethylethyl)-

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

1-tert-Butyl-1H-imidazole Basic Attributes

124.18

124.100048391 g/mol

604-604-1

DTXSID50196588

2933290090

Characteristics

17.82000

1.63810

0.92±0.1 g/cm3

105°C/12mmHg(lit.)

85.8ºC

1.4800 to 1.4840

7.22±0.30

Safety Information

|Danger|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:124.18
XLogP3:0.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:124.100048391
Monoisotopic Mass:124.100048391
Topological Polar Surface Area:17.8
Heavy Atom Count:9
Complexity:93.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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