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82819-77-0 | 2-Propenenitrile,3-(1H-benzimidazol-1-yl)-(9CI)
CAS No: 82819-77-0 Catalog No: AG00GJWY MDL No:
Product Description
Catalog Number:
AG00GJWY
Chemical Name:
2-Propenenitrile,3-(1H-benzimidazol-1-yl)-(9CI)
CAS Number:
82819-77-0
IUPAC Name:
(E)-3-(benzimidazol-1-yl)prop-2-enenitrile
InChI:
InChI=1S/C10H7N3/c11-6-3-7-13-8-12-9-4-1-2-5-10(9)13/h1-5,7-8H/b7-3+
InChI Key:
DSJIRQBSQMUEET-XVNBXDOJSA-N
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
169.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.187g/mol
Monoisotopic Mass:
169.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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