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Home Aldehydes 1H-Benzoimidazole-2-carboxaldehyde

1H-Benzoimidazole-2-carboxaldehyde

CAS No.:
3314-30-5
Catalog Number:
AG00BXMB
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
10g
95%
In Stock USA
United States
$225
- +
25g
95%
In Stock USA
United States
$457
- +
Product Description
Catalog Number:
AG00BXMB
Chemical Name:
1H-Benzoimidazole-2-carboxaldehyde
CAS Number:
3314-30-5
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
MDL Number:
MFCD00228045
IUPAC Name:
1H-benzimidazole-2-carbaldehyde
InChI:
InChI=1S/C8H6N2O/c11-5-8-9-6-3-1-2-4-7(6)10-8/h1-5H,(H,9,10)
InChI Key:
DQOSJWYZDQIMGM-UHFFFAOYSA-N
SMILES:
O=Cc1nc2c([nH]1)cccc2
EC Number:
222-004-3
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Synthesis of substituted benzimidazolyl curcumin mimics and their anticancer activity. Bioorganic & medicinal chemistry letters 20120115
N-(4,6-Dimethyl-pyrimidin-2-yl)-1H-benzimidazol-2-amine. Acta crystallographica. Section E, Structure reports online 20110301
1,4-Bis(1H-benzimidazol-2-yl)benzene methanol monosolvate. Acta crystallographica. Section E, Structure reports online 20110101
Tailored ligand acceleration of the Cu-catalyzed azide-alkyne cycloaddition reaction: practical and mechanistic implications. Journal of the American Chemical Society 20101020
Copper-catalyzed annulation of 2-formylazoles with o-aminoiodoarenes. The Journal of organic chemistry 20100205
2-Benzimidazolyl-9-(chroman-4-yl)-purinone derivatives as JAK3 inhibitors. Bioorganic & medicinal chemistry letters 20091201
Properties