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2-amino-1-methylbenzimidazole-5-carbonitrile

2-amino-1-methylbenzimidazole-5-carbonitrile structure

CAS No:
141691-41-0
Formula:
C9H8N4
Chemical Name:
2-amino-1-methylbenzimidazole-5-carbonitrile
Synonyms:
141691-41-0;1H-Benzimidazole-5-carbonitrile, 2-amino-1-methyl-;5-Cyano-1-methyl-2-aminobenzimidazole;2-Amino-1-methyl-1H-benzimidazole-5-carbonitrile;2-amino-1-methyl-1H-1,3-benzodiazole-5-carbonitrile;CCRIS 4363;2-amino-1-methylbenzimidazole-5-carbonitrile;SCHEMBL21688805;DTXSID60161803;AKOS006279829

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2-amino-1-methylbenzimidazole-5-carbonitrile Basic Attributes

Molecular Weight：

172.19 g/mol

Exact Mass：

172.074896272 g/mol

DSSTox ID：

DTXSID60161803

Characteristics

PSA：

67.6 Å²

XLogP3：

1.11 (LogP)

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, 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:172.19
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:172.074896272
Monoisotopic Mass:172.074896272
Topological Polar Surface Area:67.6
Heavy Atom Count:13
Complexity:243
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-amino-1-methylbenzimidazole-5-carbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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