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21003-80-5 | Benzoic acid, 2-[(3-benzoylphenyl)amino]-
CAS No: 21003-80-5 Catalog No: AG002KIZ MDL No:
Product Description
Catalog Number:
AG002KIZ
Chemical Name:
Benzoic acid, 2-[(3-benzoylphenyl)amino]-
CAS Number:
21003-80-5
Molecular Formula:
C20H15NO3
Molecular Weight:
317.3380
IUPAC Name:
2-(3-benzoylanilino)benzoic acid
InChI:
InChI=1S/C20H15NO3/c22-19(14-7-2-1-3-8-14)15-9-6-10-16(13-15)21-18-12-5-4-11-17(18)20(23)24/h1-13,21H,(H,23,24)
InChI Key:
HUEYEAPOFINHSA-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)c1cccc(c1)Nc1ccccc1C(=O)O
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.105g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
317.344g/mol
Monoisotopic Mass:
317.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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