Chemical Properties of [1,1'-Biphenyl]-4-carbonitrile, 4'-(heptyloxy)- (CAS 52364-72-4)

[1,1'-Biphenyl]-4-carbonitrile, 4'-(heptyloxy)-

InChI
InChI=1S/C20H23NO/c1-2-3-4-5-6-15-22-20-13-11-19(12-14-20)18-9-7-17(16-21)8-10-18/h7-14H,2-6,15H2,1H3
InChI Key
JPBFKTCKZLMJED-UHFFFAOYSA-N
Formula
C20H23NO
SMILES
CCCCCCCOc1ccc(-c2ccc(C#N)cc2)cc1
Molecular Weight1
293.40
CAS
52364-72-4
Other Names
  • 4'-(heptyloxy)-4-biphenylcarbonitrile
  • 4'-(heptyloxy)[1,1'-biphenyl]-4-carbonitrile
  • 4-cyano-4'-heptyloxybiphenyl
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Physical Properties

Property Value Unit Source
ω 0.8167 Relay (1.0) Calculated Property
ΔfG° 351.26 kJ/mol Joback Calculated Property
ΔfH°gas 7.51 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.55 kJ/mol Joback Calculated Property
ΔvapH° 109.59 kJ/mol Relay (1.0) Calculated Property
IE 8.38 eV Relay (1.0) Calculated Property
log10WS -6.91 Relay (1.0) Calculated Property
logPoct/wat 5.574 Crippen Calculated Property
McVol 252.390 ml/mol McGowan Calculated Property
Pc 1540.29 kPa Joback Calculated Property
Tboil 690.42 K Relay (1.0) Calculated Property
Tc 916.53 K Relay (1.0) Calculated Property
Tfus 326.70 ± 0.20 K NIST
Vc 0.930 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [747.66; 822.30] J/mol×K [844.82; 1070.32] Show Hide
Cp,gas 747.66 J/mol×K 844.82 Joback Calculated Property
Cp,gas 762.81 J/mol×K 882.40 Joback Calculated Property
Cp,gas 776.80 J/mol×K 919.99 Joback Calculated Property
Cp,gas 789.70 J/mol×K 957.57 Joback Calculated Property
Cp,gas 801.54 J/mol×K 995.15 Joback Calculated Property
Cp,gas 812.39 J/mol×K 1032.74 Joback Calculated Property
Cp,gas 822.30 J/mol×K 1070.32 Joback Calculated Property

Similar Compounds

[1,1'-Biphenyl]-4-carbonitrile, 4'-(octyloxy)-. [1,1'-Biphenyl]-4-carbonitrile, 4'-(hexyloxy)-. [1,1'-Biphenyl]-4-carbonitrile, 4'-(pentyloxy)-. [1,1'-Biphenyl]-4-carbonitrile, 4'-butoxy-. [1,1'-Biphenyl]-4-carbonitrile, 4'-propoxy-. p-Octyloxybenzonitrile. Adipic acid, 4-biphenyl octyl ester. Adipic acid, 4-biphenyl decyl ester. Adipic acid, 4-biphenyl nonyl ester. Adipic acid, 4-biphenyl heptyl ester. Adipic acid, 4-biphenyl hexyl ester. Sebacic acid, pentyl 4-phenylphenyl ester. Succinic acid, 4-biphenyl nonyl ester. Succinic acid, 4-biphenyl octyl ester. Succinic acid, 4-biphenyl tridecyl ester.

Find more compounds similar to [1,1'-Biphenyl]-4-carbonitrile, 4'-(heptyloxy)-.

Mixtures

Sources

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