Chemical Properties of 3-(trifluoromethyl)phenoxyacetonitrile (CAS 2145-31-5)

3-(trifluoromethyl)phenoxyacetonitrile

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InChI
InChI=1S/C9H6F3NO/c10-9(11,12)7-2-1-3-8(6-7)14-5-4-13/h1-3,6H,5H2
InChI Key
UGZFDPFADQHEMW-UHFFFAOYSA-N
Formula
C9H6F3NO
SMILES
N#CCOc1cccc(C(F)(F)F)c1
Molecular Weight1
201.15
CAS
2145-31-5
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Physical Properties

Property Value Unit Source
Δf -425.73 kJ/mol Joback Calculated Property
Δfgas -568.45 kJ/mol Joback Calculated Property
Δfus 17.24 kJ/mol Joback Calculated Property
Δvap 47.71 kJ/mol Joback Calculated Property
log10WS -2.98 Crippen Calculated Property
logPoct/wat 2.608 Crippen Calculated Property
McVol 126.470 ml/mol McGowan Calculated Property
Pc 2701.41 kPa Joback Calculated Property
Tboil 556.06 K Joback Calculated Property
Tc 762.45 K Joback Calculated Property
Tfus 321.54 K Joback Calculated Property
Vc 0.518 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [294.19; 344.81] J/mol×K [556.06; 762.45] Show Hide
Cp,gas 294.19 J/mol×K 556.06 Joback Calculated Property
Cp,gas 304.24 J/mol×K 590.46 Joback Calculated Property
Cp,gas 313.60 J/mol×K 624.86 Joback Calculated Property
Cp,gas 322.31 J/mol×K 659.25 Joback Calculated Property
Cp,gas 330.39 J/mol×K 693.65 Joback Calculated Property
Cp,gas 337.88 J/mol×K 728.05 Joback Calculated Property
Cp,gas 344.81 J/mol×K 762.45 Joback Calculated Property

Similar Compounds

Benzonitrile, 3-ethoxy-. m-Methoxybenzontrile. 2-Fluoro-3-(trifluoromethyl)phenol, methyl ether. (3-methylphenoxy)acetic acid. Benzaldehyde, 3-ethoxy-. Benzene, 1-methoxy-3-methyl-. 4-Methylphenoxyacetonitrile. Phenol, 3-(trifluoromethyl)-. Benzoic acid, 3-ethoxy-, methyl ester. Benzamide, 3-ethoxy-. Benzoic acid, 3-methoxy-. o-Methoxybenzonitrile. Benzoic acid, 3-ethyloxy-, ethyl ester. Benzonitrile, 2,3-dimethoxy-. Benzaldehyde, 3-methoxy-.

Find more compounds similar to 3-(trifluoromethyl)phenoxyacetonitrile.

Sources

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