Chemical Properties of Dimyrcene isomer # 2

InChI

InChI=1S/C20H32/c1-6-20(14-8-11-18(4)5)15-9-13-19(16-20)12-7-10-17(2)3/h6,10-11,13H,1,7-9,12,14-16H2,2-5H3

InChI Key

DWVQYLNPEHLULX-UHFFFAOYSA-N

Formula

C20H32

SMILES

C=CC1(CCC=C(C)C)CCC=C(CCC=C(C)C)C1

Molecular Weight¹

272.47

• 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).
• I_np : Non-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
ΔfG°	387.99	kJ/mol	Joback Calculated Property
ΔfH°gas	0.03	kJ/mol	Joback Calculated Property
ΔfusH°	30.43	kJ/mol	Joback Calculated Property
ΔvapH°	59.75	kJ/mol	Joback Calculated Property
log10WS	-7.26		Crippen Calculated Property
logPoct/wat	6.762		Crippen Calculated Property
McVol	264.600	ml/mol	McGowan Calculated Property
Pc	1360.63	kPa	Joback Calculated Property
Inp	[1950.00; 1950.00]
Inp	1950.00		NIST
Inp	1950.00		NIST
Tboil	685.69	K	Joback Calculated Property
Tc	892.56	K	Joback Calculated Property
Tfus	319.88	K	Joback Calculated Property
Vc	1.016	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[744.04; 862.97]	J/mol×K	[685.69; 892.56]
Cp,gas	744.04	J/mol×K	685.69	Joback Calculated Property
Cp,gas	765.92	J/mol×K	720.17	Joback Calculated Property
Cp,gas	786.77	J/mol×K	754.65	Joback Calculated Property
Cp,gas	806.75	J/mol×K	789.12	Joback Calculated Property
Cp,gas	826.00	J/mol×K	823.60	Joback Calculated Property
Cp,gas	844.69	J/mol×K	858.08	Joback Calculated Property
Cp,gas	862.97	J/mol×K	892.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dimyrcene isomer # 2.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.