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Home > Imidazoles > 89869-47-6
89869-47-6 | Phenol, 1H-benzimidazolyl-
CAS No: 89869-47-6 Catalog No: AG006PBQ MDL No:
Product Description
Catalog Number:
AG006PBQ
Chemical Name:
Phenol, 1H-benzimidazolyl-
CAS Number:
89869-47-6
Molecular Formula:
C13H10N2O
Molecular Weight:
210.2313
IUPAC Name:
2-(benzimidazol-1-yl)phenol
InChI:
InChI=1S/C13H10N2O/c16-13-8-4-3-7-12(13)15-9-14-10-5-1-2-6-11(10)15/h1-9,16H
InChI Key:
CVPOWJXYMCMMPD-UHFFFAOYSA-N
SMILES:
Oc1ccccc1n1cnc2c1cccc2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.236g/mol
Monoisotopic Mass:
210.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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