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89646-24-2 | Benzoic acid, 3-amino-2-(2-hydroxybenzoyl)-
CAS No: 89646-24-2 Catalog No: AG003VHS MDL No:
Product Description
Catalog Number:
AG003VHS
Chemical Name:
Benzoic acid, 3-amino-2-(2-hydroxybenzoyl)-
CAS Number:
89646-24-2
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
IUPAC Name:
3-amino-2-(2-hydroxybenzoyl)benzoic acid
InChI:
InChI=1S/C14H11NO4/c15-10-6-3-5-9(14(18)19)12(10)13(17)8-4-1-2-7-11(8)16/h1-7,16H,15H2,(H,18,19)
InChI Key:
UEBKJFKETXTBQM-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1C(=O)c1ccccc1O)N
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.069g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
257.245g/mol
Monoisotopic Mass:
257.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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