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Home Other Building Blocks 3-Benzoimidazol-1-yl-propionic acid

3-Benzoimidazol-1-yl-propionic acid

CAS No.:
14840-18-7
Catalog Number:
AG001KWG
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
95%
In Stock USA
United States
$175
- +
10g
95%
In Stock USA
United States
$319
- +
25g
95%
In Stock USA
United States
$594
- +
Product Description
Catalog Number:
AG001KWG
Chemical Name:
3-Benzoimidazol-1-yl-propionic acid
CAS Number:
14840-18-7
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD00817167
IUPAC Name:
3-(benzimidazol-1-yl)propanoic acid
InChI:
InChI=1S/C10H10N2O2/c13-10(14)5-6-12-7-11-8-3-1-2-4-9(8)12/h1-4,7H,5-6H2,(H,13,14)
InChI Key:
XKGRXBQGCQJOHQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCn1cnc2c1cccc2
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
The structure of (S)-(-)-4-(2-benzimidazolyl)-4-hydroxybutyric acid formed during mammalian metabolism of the fungicide 2-(2-furyl)benzimidazole. Basic & clinical pharmacology & toxicology 20050401
Properties