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69984-76-5 | 1H-Benzimidazole-7-carbonitrile(9CI)
CAS No: 69984-76-5 Catalog No: AG00FGVB MDL No:
Product Description
Catalog Number:
AG00FGVB
Chemical Name:
1H-Benzimidazole-7-carbonitrile(9CI)
CAS Number:
69984-76-5
IUPAC Name:
1H-benzimidazole-4-carbonitrile
InChI:
InChI=1S/C8H5N3/c9-4-6-2-1-3-7-8(6)11-5-10-7/h1-3,5H,(H,10,11)
InChI Key:
LJYFETXSAWJLNA-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.149g/mol
Monoisotopic Mass:
143.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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