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89521-59-5 | Methanone, (4-hydroxy-1H-benzimidazol-2-yl)phenyl-
CAS No: 89521-59-5 Catalog No: AG0087AJ MDL No:
Product Description
Catalog Number:
AG0087AJ
Chemical Name:
Methanone, (4-hydroxy-1H-benzimidazol-2-yl)phenyl-
CAS Number:
89521-59-5
Molecular Formula:
C14H10N2O2
Molecular Weight:
238.2414
IUPAC Name:
(4-hydroxy-1H-benzimidazol-2-yl)-phenylmethanone
InChI:
InChI=1S/C14H10N2O2/c17-11-8-4-7-10-12(11)16-14(15-10)13(18)9-5-2-1-3-6-9/h1-8,17H,(H,15,16)
InChI Key:
HGFXFRNIEKXMCA-UHFFFAOYSA-N
SMILES:
O=C(c1nc2c([nH]1)cccc2O)c1ccccc1
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.246g/mol
Monoisotopic Mass:
238.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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