4-(3-fluoropyridin-2-yl)benzoic acid

4-(3-fluoropyridin-2-yl)benzoic acid

CAS: 1260650-69-8

Formula: C12H8FNO2

SMILES: OC(=O)C1=CC=C(C=C1)C1=NC=CC=C1F

IUPAC: 4-(3-fluoropyridin-2-yl)benzoic acid

InChI: InChI=1S/C12H8FNO2/c13-10-2-1-7-14-11(10)8-3-5-9(6-4-8)12(15)16/h1-7H,(H,15,16)

Composition: C (66.36%), H (3.71%), F (8.75%), N (6.45%), O (14.73%)

Molar Mass: 217.199

Atom Count: 24

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	217.053906665
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PJLFLAVUDJSGDA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.14
Topological Polar Surface Area	50.19
Polarizability	22.36
Ring Count	2
Rotatable Bond Count	2

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