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893613-05-3 | Benzoic acid,3-amino-2-([1,1'-biphenyl]-2-ylamino)-
CAS No: 893613-05-3 Catalog No: AG003X5E MDL No:MFCD08056213
Product Description
Catalog Number:
AG003X5E
Chemical Name:
Benzoic acid,3-amino-2-([1,1'-biphenyl]-2-ylamino)-
CAS Number:
893613-05-3
Molecular Formula:
C19H16N2O2
Molecular Weight:
304.3425
MDL Number:
MFCD08056213
IUPAC Name:
3-amino-2-(2-phenylanilino)benzoic acid
InChI:
InChI=1S/C19H16N2O2/c20-16-11-6-10-15(19(22)23)18(16)21-17-12-5-4-9-14(17)13-7-2-1-3-8-13/h1-12,21H,20H2,(H,22,23)
InChI Key:
ITZDTEMQHMKVFN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1Nc1ccccc1c1ccccc1)N
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.121g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
304.349g/mol
Monoisotopic Mass:
304.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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