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Home > Imidazoles > 4589-66-6
4589-66-6 | 1H-Benzimidazole-5-methanol,1,2-dimethyl-(9CI)
CAS No: 4589-66-6 Catalog No: AG00DWH7 MDL No:MFCD02690737
Product Description
Catalog Number:
AG00DWH7
Chemical Name:
1H-Benzimidazole-5-methanol,1,2-dimethyl-(9CI)
CAS Number:
4589-66-6
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD02690737
IUPAC Name:
(1,2-dimethylbenzimidazol-5-yl)methanol
InChI:
InChI=1S/C10H12N2O/c1-7-11-9-5-8(6-13)3-4-10(9)12(7)2/h3-5,13H,6H2,1-2H3
InChI Key:
DTWCONPNVHZPJS-UHFFFAOYSA-N
SMILES:
OCc1ccc2c(c1)nc(n2C)C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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