Home Carbonyls 2-[2-(methoxycarbonyl)phenyl]benzoic acid

2-[2-(methoxycarbonyl)phenyl]benzoic acid

CAS No.:
6926-84-7
Catalog Number:
AG01A3WI
Molecular Formula:
C15H12O4
Molecular Weight:
256.2534
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Product Description
Catalog Number:
AG01A3WI
Chemical Name:
2-[2-(methoxycarbonyl)phenyl]benzoic acid
CAS Number:
6926-84-7
Molecular Formula:
C15H12O4
Molecular Weight:
256.2534
MDL Number:
MFCD00223287
IUPAC Name:
2-(2-methoxycarbonylphenyl)benzoic acid
InChI:
InChI=1S/C15H12O4/c1-19-15(18)13-9-5-3-7-11(13)10-6-2-4-8-12(10)14(16)17/h2-9H,1H3,(H,16,17)
InChI Key:
ZDVLTXGRPRUSHK-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1c1ccccc1C(=O)O
NSC Number:
116234
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.074g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.257g/mol
Monoisotopic Mass:
256.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties