Chemical Properties of 2,3,6-Trifluorobenzonitrile (CAS 136514-17-5)

2,3,6-Trifluorobenzonitrile

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InChI
InChI=1S/C7H2F3N/c8-5-1-2-6(9)7(10)4(5)3-11/h1-2H
InChI Key
YWTXHALVWAISPR-UHFFFAOYSA-N
Formula
C7H2F3N
SMILES
N#Cc1c(F)ccc(F)c1F
Molecular Weight1
157.09
CAS
136514-17-5
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Physical Properties

Property Value Unit Source
Δf -359.67 kJ/mol Joback Calculated Property
Δfgas -409.14 kJ/mol Joback Calculated Property
Δfus 17.51 kJ/mol Joback Calculated Property
Δvap 43.47 kJ/mol Joback Calculated Property
log10WS -2.82 Crippen Calculated Property
logPoct/wat 1.976 Crippen Calculated Property
McVol 92.420 ml/mol McGowan Calculated Property
Pc 3213.68 kPa Joback Calculated Property
Tboil 501.07 K Joback Calculated Property
Tc 705.21 K Joback Calculated Property
Tfus 299.39 K Joback Calculated Property
Vc 0.400 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [184.66; 219.52] J/mol×K [501.07; 705.21] Show Hide
Cp,gas 184.66 J/mol×K 501.07 Joback Calculated Property
Cp,gas 191.32 J/mol×K 535.09 Joback Calculated Property
Cp,gas 197.63 J/mol×K 569.12 Joback Calculated Property
Cp,gas 203.60 J/mol×K 603.14 Joback Calculated Property
Cp,gas 209.23 J/mol×K 637.16 Joback Calculated Property
Cp,gas 214.54 J/mol×K 671.18 Joback Calculated Property
Cp,gas 219.52 J/mol×K 705.21 Joback Calculated Property

Similar Compounds

Benzonitrile, 2,6-difluoro-. 2,3,4-Trifluorobenzonitrile. 2,5-Difluorobenzonitrile. Benzonitrile, 2-fluoro-. 2,3,6-Trifluorobenzaldehyde. 2,3,6-Trifluorobenzoyl chloride. Benzonitrile, 3-fluoro-. 2,3,6-Trifluorobenzylbromide. 2,3,6-Trifluorobenzoic acid. 2,3,6-Trifluorobenzyl alcohol. 2,3,6-Trifluorobenzamide. 2,3,6-Trifluoroacetophenone. 2-Fluoro-6-iodobenzonitrile. 2,6-Difluorotoluene. Benzene, 1,2,4,5-tetrafluoro-3-(trifluoromethyl)-.

Find more compounds similar to 2,3,6-Trifluorobenzonitrile.

Sources

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