4'-formyl-[1,1'-biphenyl]-4-carboxylic acid

4'-formyl-[1,1'-biphenyl]-4-carboxylic acid

CAS: 70916-98-2

Formula: C14H10O3

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

IUPAC: 4'-formyl-[1,1'-biphenyl]-4-carboxylic acid

InChI: InChI=1S/C14H10O3/c15-9-10-1-3-11(4-2-10)12-5-7-13(8-6-12)14(16)17/h1-9H,(H,16,17)

Composition: C (74.33%), H (4.46%), O (21.22%)

Molar Mass: 226.231

Atom Count: 27

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	226.062994182
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JCEAFZUEUSBESW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.03
Topological Polar Surface Area	54.37
Polarizability	25.5
Ring Count	2
Rotatable Bond Count	3

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