4-(4-chloro-3-fluorophenoxy)benzoic acid

4-(4-chloro-3-fluorophenoxy)benzoic acid

CAS: 551921-67-6

Formula: C13H8ClFO3

SMILES: OC(=O)C1=CC=C(OC2=CC(F)=C(Cl)C=C2)C=C1

IUPAC: 4-(4-chloro-3-fluorophenoxy)benzoic acid

InChI: InChI=1S/C13H8ClFO3/c14-11-6-5-10(7-12(11)15)18-9-3-1-8(2-4-9)13(16)17/h1-7H,(H,16,17)

Composition: C (58.56%), H (3.02%), Cl (13.29%), F (7.12%), O (18.00%)

Molar Mass: 266.65

Atom Count: 26

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	266.0146
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FYMLDFYAKARAJP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.58
Topological Polar Surface Area	46.53
Polarizability	24.63
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	551921-67-6		$51.35-$1,347.05$51.35$63.37$86.31$292.79$449.02$1,347.05