biphenyl-3-carboxylic acid

biphenyl-3-carboxylic acid

CAS: 716-76-7

Formula: C13H10O2

SMILES: OC(=O)C1=CC=CC(=C1)C1=CC=CC=C1

IUPAC: [1,1'-biphenyl]-3-carboxylic acid

InChI: InChI=1S/C13H10O2/c14-13(15)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H,(H,14,15)

Composition: C (78.77%), H (5.09%), O (16.14%)

Molar Mass: 198.221

Atom Count: 25

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	198.068079562
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XNLWJFYYOIRPIO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.45
Topological Polar Surface Area	37.3
Polarizability	23.64
Ring Count	2
Rotatable Bond Count	2

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