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Home > Imidazoles > 89469-28-3
89469-28-3 | Phenol, 4-(1H-benzimidazol-2-yl)-3-methoxy-
CAS No: 89469-28-3 Catalog No: AG0042A8 MDL No:
Product Description
Catalog Number:
AG0042A8
Chemical Name:
Phenol, 4-(1H-benzimidazol-2-yl)-3-methoxy-
CAS Number:
89469-28-3
Molecular Formula:
C14H12N2O2
Molecular Weight:
240.2573
IUPAC Name:
4-(1H-benzimidazol-2-yl)-3-methoxyphenol
InChI:
InChI=1S/C14H12N2O2/c1-18-13-8-9(17)6-7-10(13)14-15-11-4-2-3-5-12(11)16-14/h2-8,17H,1H3,(H,15,16)
InChI Key:
BBTJMPRZCOTMPV-UHFFFAOYSA-N
SMILES:
COc1cc(O)ccc1c1nc2c([nH]1)cccc2
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.262g/mol
Monoisotopic Mass:
240.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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