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4-benzamidobenzoic acid

4-benzamidobenzoic acid

CAS: 582-80-9

Formula: C14H11NO3

SMILES: OC(=O)C1=CC=C(NC(=O)C2=CC=CC=C2)C=C1

IUPAC: 4-benzamidobenzoic acid

InChI: InChI=1S/C14H11NO3/c16-13(10-4-2-1-3-5-10)15-12-8-6-11(7-9-12)14(17)18/h1-9H,(H,15,16)(H,17,18)

Composition: C (69.70%), H (4.60%), N (5.81%), O (19.90%)

Molar Mass: 241.246

Atom Count: 29

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 241.073893218
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey UZKKMWJMAJGMPF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.85
Topological Polar Surface Area 66.4
Polarizability 25.26
Ring Count 2
Rotatable Bond Count 3

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