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Home > Imidazoles > 126824-21-3
126824-21-3 | 1H-Benzimidazole-6-methanol, 2-(4-methoxyphenyl)-
CAS No: 126824-21-3 Catalog No: AG000T9O MDL No:
Product Description
Catalog Number:
AG000T9O
Chemical Name:
1H-Benzimidazole-6-methanol, 2-(4-methoxyphenyl)-
CAS Number:
126824-21-3
Molecular Formula:
C15H14N2O2
Molecular Weight:
254.2839
IUPAC Name:
[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]methanol
InChI:
InChI=1S/C15H14N2O2/c1-19-12-5-3-11(4-6-12)15-16-13-7-2-10(9-18)8-14(13)17-15/h2-8,18H,9H2,1H3,(H,16,17)
InChI Key:
IJSDRXXCODJCRK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc2c([nH]1)cc(cc2)CO
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.289g/mol
Monoisotopic Mass:
254.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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