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1H-Benzimidazole-2-Carbonitrile 3-Oxide
[CAS# 57097-49-1]

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Identification
Name 1H-Benzimidazole-2-Carbonitrile 3-Oxide
Synonyms 2-cyano-1H-benzo[d]imidazole 3-oxide
Molecular Structure CAS#: 57097-49-1, 1H-Benzimidazole-2-Carbonitrile 3-Oxide
Molecular Formula C8H5N3O
Molecular Weight 159.15
CAS Registry Number 57097-49-1
SMILES c1ccc2c(c1)[nH]c([n+]2[O-])C#N
InChI 1S/C8H5N3O/c9-5-8-10-6-3-1-2-4-7(6)11(8)12/h1-4,10H
InChIKey KQHSXODKKAYPPC-UHFFFAOYSA-N
Properties
Density 1.398g/cm3 (Cal.)
Boiling point 405.484°C at 760 mmHg (Cal.)
Flash point 199.03°C (Cal.)
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