Chemical Properties of 1,3,5-Pentanetricarbonitrile, 3-phenyl (CAS 16320-20-0)

InChI

InChI=1S/C14H13N3/c15-10-4-8-14(12-17,9-5-11-16)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-9H2

InChI Key

KVDYEBISIZWSRT-UHFFFAOYSA-N

Formula

C14H13N3

SMILES

N#CCCC(C#N)(CCC#N)c1ccccc1

Molecular Weight¹

223.27

CAS

16320-20-0

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[521.08; 570.40]	J/mol×K	[849.41; 1091.29]
Cp,gas	521.08	J/mol×K	849.41	Joback Calculated Property
Cp,gas	530.81	J/mol×K	889.72	Joback Calculated Property
Cp,gas	539.81	J/mol×K	930.04	Joback Calculated Property
Cp,gas	548.18	J/mol×K	970.35	Joback Calculated Property
Cp,gas	556.01	J/mol×K	1010.67	Joback Calculated Property
Cp,gas	563.38	J/mol×K	1050.98	Joback Calculated Property
Cp,gas	570.40	J/mol×K	1091.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,3,5-Pentanetricarbonitrile, 3-phenyl.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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