200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 878436-85-2
878436-85-2 | 4-(1-Ethyl-1H-benzoimidazol-2-yl)-butyric acid
CAS No: 878436-85-2 Catalog No: AG01EY4H MDL No:
Product Description
Catalog Number:
AG01EY4H
Chemical Name:
4-(1-Ethyl-1H-benzoimidazol-2-yl)-butyric acid
CAS Number:
878436-85-2
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
IUPAC Name:
4-(1-ethylbenzimidazol-2-yl)butanoic acid
InChI:
InChI=1S/C13H16N2O2/c1-2-15-11-7-4-3-6-10(11)14-12(15)8-5-9-13(16)17/h3-4,6-7H,2,5,8-9H2,1H3,(H,16,17)
InChI Key:
YWGBWXFMJJEGAH-UHFFFAOYSA-N
SMILES:
CCn1c(CCCC(=O)O)nc2c1cccc2
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.