3-fluorobenzoic acid

3-fluorobenzoic acid

CAS: 455-38-9

Formula: C7H5FO2

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

IUPAC: 3-fluorobenzoic acid

InChI: InChI=1S/C7H5FO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)

Composition: C (60.01%), H (3.60%), F (13.56%), O (22.84%)

Molar Mass: 140.113

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	M-fluorobenzoic acid
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	140.027357564
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MXNBDFWNYRNIBH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.53
Topological Polar Surface Area	37.3
Polarizability	12.41
Ring Count	1
Rotatable Bond Count	1

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