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14716-42-8 | Benzenamine, 2-(1H-benzimidazol-1-ylmethyl)-
CAS No: 14716-42-8 Catalog No: AG001EOH MDL No:
Product Description
Catalog Number:
AG001EOH
Chemical Name:
Benzenamine, 2-(1H-benzimidazol-1-ylmethyl)-
CAS Number:
14716-42-8
Molecular Formula:
C14H13N3
Molecular Weight:
223.2731
IUPAC Name:
2-(benzimidazol-1-ylmethyl)aniline
InChI:
InChI=1S/C14H13N3/c15-12-6-2-1-5-11(12)9-17-10-16-13-7-3-4-8-14(13)17/h1-8,10H,9,15H2
InChI Key:
ZDSSFKCWVMNIII-UHFFFAOYSA-N
SMILES:
Nc1ccccc1Cn1cnc2c1cccc2
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.279g/mol
Monoisotopic Mass:
223.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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