Chemical Properties of Acora-2,4-diene

InChI

InChI=1S/C15H24/c1-11(2)14-6-5-13(4)15(14)9-7-12(3)8-10-15/h7-9,11,13-14H,5-6,10H2,1-4H3/t13-,14+,15-/m1/s1

InChI Key

ZQMYLSWMANINAL-QLFBSQMISA-N

Formula

C15H24

SMILES

CC1=CCC2(C=C1)C(C)CCC2C(C)C

Molecular Weight¹

204.35

Other Names

• Acora-3,5-diene

• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• 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

Property	Value	Unit	Source
ω	0.2954		Relay (1.0) Calculated Property
ΔfG°	183.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-7.54	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	15.78	kJ/mol	Joback Calculated Property
ΔvapH°	64.17	kJ/mol	Relay (1.0) Calculated Property
IE	7.89	eV	Relay (1.0) Calculated Property
log10WS	-5.50		Relay (1.0) Calculated Property
logPoct/wat	4.581		Crippen Calculated Property
McVol	191.890	ml/mol	McGowan Calculated Property
Pc	2027.23	kPa	Joback Calculated Property
Inp	[1421.00; 1421.00]
Inp	1421.00		NIST
Inp	1421.00		NIST
I	1601.00		NIST
Tboil	515.59	K	Relay (1.0) Calculated Property
Tc	726.98	K	Relay (1.0) Calculated Property
Tfus	270.39	K	Relay (1.0) Calculated Property
Vc	0.644	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[501.14; 620.81]	J/mol×K	[571.59; 794.61]
Cp,gas	501.14	J/mol×K	571.59	Joback Calculated Property
Cp,gas	524.19	J/mol×K	608.76	Joback Calculated Property
Cp,gas	545.79	J/mol×K	645.93	Joback Calculated Property
Cp,gas	566.10	J/mol×K	683.10	Joback Calculated Property
Cp,gas	585.27	J/mol×K	720.27	Joback Calculated Property
Cp,gas	603.45	J/mol×K	757.44	Joback Calculated Property
Cp,gas	620.81	J/mol×K	794.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to Acora-2,4-diene.

Sources

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

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