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Home > Imidazoles > 824394-84-5
824394-84-5 | 1H-Benzimidazol-4-ol, 2-[2-(1H-imidazol-2-yl)phenyl]-
CAS No: 824394-84-5 Catalog No: AG008JVN MDL No:
Product Description
Catalog Number:
AG008JVN
Chemical Name:
1H-Benzimidazol-4-ol, 2-[2-(1H-imidazol-2-yl)phenyl]-
CAS Number:
824394-84-5
Molecular Formula:
C16H12N4O
Molecular Weight:
276.2927
IUPAC Name:
2-[2-(1H-imidazol-2-yl)phenyl]-1H-benzimidazol-4-ol
InChI:
InChI=1S/C16H12N4O/c21-13-7-3-6-12-14(13)20-16(19-12)11-5-2-1-4-10(11)15-17-8-9-18-15/h1-9,21H,(H,17,18)(H,19,20)
InChI Key:
RDNGFQHDHCBSEB-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1nc([nH]2)c1ccccc1c1ncc[nH]1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.101g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
276.299g/mol
Monoisotopic Mass:
276.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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