Chemical Properties of P-fluorophenoxyacetic acid (CAS 405-79-8)

P-fluorophenoxyacetic acid

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InChI
InChI=1S/C8H7FO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
InChI Key
ZBIULCVFFJJYTN-UHFFFAOYSA-N
Formula
C8H7FO3
SMILES
O=C(O)COc1ccc(F)cc1
Molecular Weight1
170.14
CAS
405-79-8
Other Names
  • 4-Fluorophenoxyacetic acid
  • Acetic acid, (4-fluorophenoxy)-
Sources

Physical Properties

Property Value Unit Source
Δf -446.29 kJ/mol Joback Calculated Property
Δfgas -576.53 kJ/mol Joback Calculated Property
Δfus 20.08 kJ/mol Joback Calculated Property
Δvap 61.36 kJ/mol Joback Calculated Property
logPoct/wat 1.29 Crippen Calculated Property
Pc 4021.02 kPa Joback Calculated Property
Tboil 581.84 K Joback Calculated Property
Tc 777.80 K Joback Calculated Property
Tfus 352.43 K Joback Calculated Property
Vc 0.44 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 265.76 J/mol×K 581.84 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 1
=CH- (ring) 4
-OH (alcohol) 1
=C< (ring) 2
-CH2- 1
>C=O (nonring) 1

Similar Compounds

Acetic acid, phenoxy-. Benzene, 1-ethoxy-4-fluoro-. Phenol,4-fluoro-,acetate. Acetic acid, (4-methoxyphenoxy)-. Acetic acid, phenoxy-, methyl ester. 3-Methoxyphenoxyacetic acid. 4-Chlorophenoxyacetic acid. 4-Methylphenoxyacetic acid. Benzene, 1-fluoro-4-methoxy-. (4-Aminophenoxy)acetic acid hydrate. Allyl phenoxyacetate. Propanoic acid, 2-phenoxy-. Propanoic acid, 2-phenoxy-, (.+/-.)-. 4-CHLOROPHENOXYACETIC ACID, METHYL,ESTER. Acetic acid, (2-naphthyloxy)-.

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