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Home Carboxys 2-Methyl-1h-benzimidazole-5-carboxylic acid

2-Methyl-1h-benzimidazole-5-carboxylic acid

CAS No.:
709-19-3
Catalog Number:
AG00IC42
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$28
- +
5g
98%
In Stock USA
United States
$77
- +
25g
98%
In Stock USA
United States
$307
- +
100g
98%
In Stock USA
United States
$1025
- +
Product Description
Catalog Number:
AG00IC42
Chemical Name:
2-Methyl-1h-benzimidazole-5-carboxylic acid
CAS Number:
709-19-3
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD00800488
IUPAC Name:
2-methyl-3H-benzimidazole-5-carboxylic acid
InChI:
InChI=1S/C9H8N2O2/c1-5-10-7-3-2-6(9(12)13)4-8(7)11-5/h2-4H,1H3,(H,10,11)(H,12,13)
InChI Key:
GZHWABCBKGMLIE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)[nH]c(n2)C
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Fragment-based design of symmetrical bis-benzimidazoles as selective inhibitors of the trimethoprim-resistant, type II R67 dihydrofolate reductase. Journal of medicinal chemistry 20120412
New transition metal ion complexes with benzimidazole-5-carboxylic acid hydrazides with antitumor activity. European journal of medicinal chemistry 20090401
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
Properties