Home Other Building Blocks 2-(6-methyl-1H-1,3-benzodiazol-2-yl)benzoic acid

2-(6-methyl-1H-1,3-benzodiazol-2-yl)benzoic acid

CAS No.:
106242-28-8
Catalog Number:
AG01C318
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
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Product Description
Catalog Number:
AG01C318
Chemical Name:
2-(6-methyl-1H-1,3-benzodiazol-2-yl)benzoic acid
CAS Number:
106242-28-8
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
MDL Number:
MFCD08815731
IUPAC Name:
2-(6-methyl-1H-benzimidazol-2-yl)benzoic acid
InChI:
InChI=1S/C15H12N2O2/c1-9-6-7-12-13(8-9)17-14(16-12)10-4-2-3-5-11(10)15(18)19/h2-8H,1H3,(H,16,17)(H,18,19)
InChI Key:
NREFEFKHWHPJTO-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)[nH]c(n2)c1ccccc1C(=O)O
Properties
Complexity:
347  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.09g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
252.273g/mol
Monoisotopic Mass:
252.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties