Home Other Building Blocks 2-PHENYL-3H-BENZOIMIDAZOLE-4-CARBOXYLIC ACID

2-PHENYL-3H-BENZOIMIDAZOLE-4-CARBOXYLIC ACID

CAS No.:
66630-72-6
Catalog Number:
AG00FCYZ
Molecular Formula:
C14H10N2O2
Molecular Weight:
238.2414
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Product Description
Catalog Number:
AG00FCYZ
Chemical Name:
2-PHENYL-3H-BENZOIMIDAZOLE-4-CARBOXYLIC ACID
CAS Number:
66630-72-6
Molecular Formula:
C14H10N2O2
Molecular Weight:
238.2414
MDL Number:
MFCD06245480
IUPAC Name:
2-phenyl-1H-benzimidazole-4-carboxylic acid
InChI:
InChI=1S/C14H10N2O2/c17-14(18)10-7-4-8-11-12(10)16-13(15-11)9-5-2-1-3-6-9/h1-8H,(H,15,16)(H,17,18)
InChI Key:
LZGYSXDYTDCYCR-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1nc([nH]2)c1ccccc1
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.074g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
238.246g/mol
Monoisotopic Mass:
238.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties