Chemical Properties of Bicyclo[2.2.2]oct-5-ene-2-carbonitrile, 3-methyl-, (1«alpha»,2«alpha»,3«alpha»,4«alpha»)- (endo,endo) (CAS 114718-72-8)

InChI

InChI=1S/C10H15N/c1-7-8-2-4-9(5-3-8)10(7)6-11/h7-10H,2-5H2,1H3/t7-,8?,9?,10-/m0/s1

InChI Key

ZFLTZPJOKVUDPQ-NFTFJBJSSA-N

Formula

C10H13N

SMILES

CC1C2CCC(CC2)C1C#N

Molecular Weight¹

147.22

CAS

114718-72-8

• 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	[334.51; 425.50]	J/mol×K	[542.96; 766.99]
Cp,gas	334.51	J/mol×K	542.96	Joback Calculated Property
Cp,gas	352.31	J/mol×K	580.30	Joback Calculated Property
Cp,gas	368.98	J/mol×K	617.64	Joback Calculated Property
Cp,gas	384.58	J/mol×K	654.98	Joback Calculated Property
Cp,gas	399.16	J/mol×K	692.32	Joback Calculated Property
Cp,gas	412.78	J/mol×K	729.66	Joback Calculated Property
Cp,gas	425.50	J/mol×K	766.99	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.2]oct-5-ene-2-carbonitrile, 3-methyl-, (1«alpha»,2«alpha»,3«alpha»,4«alpha»)- (endo,endo).

Sources

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

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