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101895-15-2 | Benzoic acid, 2-([1,1'-biphenyl]-4-ylamino)-
CAS No: 101895-15-2 Catalog No: AG0005UC MDL No:
Product Description
Catalog Number:
AG0005UC
Chemical Name:
Benzoic acid, 2-([1,1'-biphenyl]-4-ylamino)-
CAS Number:
101895-15-2
Molecular Formula:
C19H15NO2
Molecular Weight:
289.3279
IUPAC Name:
2-(4-phenylanilino)benzoic acid
InChI:
InChI=1S/C19H15NO2/c21-19(22)17-8-4-5-9-18(17)20-16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,20H,(H,21,22)
InChI Key:
VSICPUMVMJXLOE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1Nc1ccc(cc1)c1ccccc1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.11g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
289.334g/mol
Monoisotopic Mass:
289.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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