Chemical Properties of 2,4-Cyclohexadien-1-one,6-methylene- (CAS 27890-67-1)

InChI

InChI=1S/C7H6O/c1-6-4-2-3-5-7(6)8/h2-5H,1H2

InChI Key

NSDWWGAIPUNJAX-UHFFFAOYSA-N

Formula

C7H6O

SMILES

C=C1C=CC=CC1=O

Molecular Weight¹

106.12

CAS

27890-67-1

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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	[159.01; 216.31]	J/mol×K	[449.08; 680.19]
Cp,gas	159.01	J/mol×K	449.08	Joback Calculated Property
Cp,gas	169.82	J/mol×K	487.60	Joback Calculated Property
Cp,gas	180.14	J/mol×K	526.12	Joback Calculated Property
Cp,gas	189.95	J/mol×K	564.63	Joback Calculated Property
Cp,gas	199.26	J/mol×K	603.15	Joback Calculated Property
Cp,gas	208.05	J/mol×K	641.67	Joback Calculated Property
Cp,gas	216.31	J/mol×K	680.19	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,4-Cyclohexadien-1-one,6-methylene-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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