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Home > Imidazoles > 2876-08-6
2876-08-6 | 1H-Benzimidazole, 1,2-dimethyl-
CAS No: 2876-08-6 Catalog No: AG002WEA MDL No:MFCD00022840
Product Description
Catalog Number:
AG002WEA
Chemical Name:
1H-Benzimidazole, 1,2-dimethyl-
CAS Number:
2876-08-6
Molecular Formula:
C9H10N2
Molecular Weight:
146.1891
MDL Number:
MFCD00022840
IUPAC Name:
1,2-dimethylbenzimidazole
InChI:
InChI=1S/C9H10N2/c1-7-10-8-5-3-4-6-9(8)11(7)2/h3-6H,1-2H3
InChI Key:
PJQIBTFOXWGAEN-UHFFFAOYSA-N
SMILES:
Cn1c(C)nc2c1cccc2
NSC Number:
222974
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.193g/mol
Monoisotopic Mass:
146.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Exploring the interplay of physicochemical properties, membrane permeability and giardicidal activity of some benzimidazole derivatives. | European journal of medicinal chemistry 20120601 |
| Molecular modeling of some 1H-benzimidazole derivatives with biological activity against Entamoeba histolytica: a comparative molecular field analysis study. | Bioorganic & medicinal chemistry 20070115 |
| Synthesis, cytotoxic activity on MCF-7 cell line and mutagenic activity of platinum(II) complexes with 2-substituted benzimidazole ligands. | European journal of medicinal chemistry 20030501 |
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