4-(difluoromethyl)-3,5-difluorobenzoic acid

4-(difluoromethyl)-3,5-difluorobenzoic acid

Formula: C8H4F4O2

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

IUPAC: 4-(difluoromethyl)-3,5-difluorobenzoic acid

InChI: InChI=1S/C8H4F4O2/c9-4-1-3(8(13)14)2-5(10)6(4)7(11)12/h1-2,7H,(H,13,14)

Composition: C (46.17%), H (1.94%), F (36.52%), O (15.38%)

Molar Mass: 208.112

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	208.014742021
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PSTDZQKSEAWEFV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.83
Topological Polar Surface Area	37.3
Polarizability	13.95
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C8H4F4O2		Quote Only