Chemical Properties of 1,1-Ethanediol, 2,2,2-trifluoro-1-(4-methoxyphenyl)- (CAS 110374-82-8)

1,1-Ethanediol, 2,2,2-trifluoro-1-(4-methoxyphenyl)-

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InChI
InChI=1S/C9H9F3O3/c1-15-7-4-2-6(3-5-7)8(13,14)9(10,11)12/h2-5,13-14H,1H3
InChI Key
OVYVMUARAPGOIN-UHFFFAOYSA-N
Formula
C9H9F3O3
SMILES
COc1ccc(C(O)(O)C(F)(F)F)cc1
Molecular Weight1
222.16
CAS
110374-82-8
Sources

Physical Properties

Property Value Unit Source
Δf -829.71 kJ/mol Joback Calculated Property
Δfgas -1046.54 kJ/mol Joback Calculated Property
Δfus 16.49 kJ/mol Joback Calculated Property
Δvap 69.29 kJ/mol Joback Calculated Property
logPoct/wat 1.39 Crippen Calculated Property
Pc 3476.55 kPa Joback Calculated Property
Tboil 635.11 K Joback Calculated Property
Tc 815.64 K Joback Calculated Property
Tfus 380.61 K Joback Calculated Property
Vc 0.52 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 368.60 J/mol×K 635.11 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 3
=CH- (ring) 4
-OH (alcohol) 2
=C< (ring) 2
>C< 2
-CH3 1

Similar Compounds

4-Methoxyphenyl methyl carbinol. Benzene, 1-(2,2,2-trifluoroethyl)-4-methoxy. Benzenemethanol, .alpha.-ethyl-4-methoxy-. 1-Phenyl-2,2,2-trifluoroethanol. Benzeneethanol, 2,2,2-trifluoro-1-(4-fluorophenyl). Benzeneethanol, 2,2,2-trifluoro-1-(4-chlorophenyl). 1-(4-Methoxyphenyl)propane-1,2-diol. 1-Hydroxy-1-(4-methoxyphenyl)propan-2-one. 4-hydroxy-«alpha»-methylbenzyl alcohol. Benzeneethanol, 2,2,2-trifluoro-1-(3-chlorophenyl). (S)-4-(1-Hydroxyallyl)phenyl acetate. 4,4'-Bis[2-hydroxyhexafluoroisopropyl]diphenyl ether. (.+/-.)-Octopamine, N,N,O,O'-tetramethyl-. Anisaldehyde dimethyl acetal. Octopamine.

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