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1H-BENZIMIDAZOLE-5-CARBONITRILE

1H-BENZIMIDAZOLE-5-CARBONITRILE structure

1H-BENZIMIDAZOLE-5-CARBONITRILE 

structure
  • CAS No:

    6287-83-8

  • Formula:

    C8H5N3

  • Chemical Name:

    1H-BENZIMIDAZOLE-5-CARBONITRILE

  • Synonyms:

    5-Cyanobenzimidazole;5-Cyano-1H-benzimidazole;1H-BENZIMIDAZOLE-5-CARBONITRILE;1H-1,3-Benzodiazole-5-carbonitrile;1H-benzo[d]iMidazole-6-carbonitrile;1H-benzo[d]imidazole-5-carbonitrile;1H-Benzimidazole-5-carbonitrile(9CI);1H-benzimidazole-5-carbonitrile(SALTDATA: FREE)

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

1H-BENZIMIDAZOLE-5-CARBONITRILE Basic Attributes

143.145

143.048340

12001

2933990090

Characteristics

52.47000

0.82

1.3±0.1 g/cm3

462.4±18.0 °C at 760 mmHg

147.5±6.4 °C

1.685

Safety Information

Xn

P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:143.15
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:143.048347172
Monoisotopic Mass:143.048347172
Topological Polar Surface Area:52.5
Heavy Atom Count:11
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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