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Home > Imidazoles > 50591-22-5
50591-22-5 | 1H-Benzimidazol-5-ol,1-methyl-(9CI)
CAS No: 50591-22-5 Catalog No: AG00DKFB MDL No:MFCD00456136
Product Description
Catalog Number:
AG00DKFB
Chemical Name:
1H-Benzimidazol-5-ol,1-methyl-(9CI)
CAS Number:
50591-22-5
Molecular Formula:
C8H8N2O
Molecular Weight:
148.1619
MDL Number:
MFCD00456136
IUPAC Name:
1-methylbenzimidazol-5-ol
InChI:
InChI=1S/C8H8N2O/c1-10-5-9-7-4-6(11)2-3-8(7)10/h2-5,11H,1H3
InChI Key:
NDDDURSMVVKBTL-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)ncn2C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Synthesis and biological evaluation of 1H-benzimidazol-5-ols as potent HBV inhibitors. | Bioorganic & medicinal chemistry letters 20101215 |
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