Chemical Properties of 6,9-Guaiadiene

InChI

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

InChI Key

IFJYSOWCCJPUJS-UHFFFAOYSA-N

Formula

C15H24

SMILES

CC(C)C1=CCC(C)C2=C(C1)C(C)CC2

Molecular Weight¹

204.35

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-27.44	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	20.23	kJ/mol	Joback Calculated Property
ΔvapH°	66.83	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	4.725		Crippen Calculated Property
McVol	191.890	ml/mol	McGowan Calculated Property
Inp	[1442.00; 1445.00]
Inp	1444.00		NIST
Inp	1444.00		NIST
Inp	1444.00		NIST
Inp	1444.00		NIST
Inp	1445.00		NIST
Inp	1444.00		NIST
Inp	Outlier 1442.00		NIST
Inp	1444.00		NIST
I	[1617.00; 1626.00]
I	1625.00		NIST
I	Outlier 1626.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1617.00		NIST
I	1625.00		NIST
I	1617.00		NIST
Tboil	527.41	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[503.36; 617.15]	J/mol×K	[586.18; 802.71]
Cp,gas	503.36	J/mol×K	586.18	Joback Calculated Property
Cp,gas	525.34	J/mol×K	622.27	Joback Calculated Property
Cp,gas	546.04	J/mol×K	658.36	Joback Calculated Property
Cp,gas	565.53	J/mol×K	694.44	Joback Calculated Property
Cp,gas	583.84	J/mol×K	730.53	Joback Calculated Property
Cp,gas	601.03	J/mol×K	766.62	Joback Calculated Property
Cp,gas	617.15	J/mol×K	802.71	Joback Calculated Property
η	[0.0002985; 0.0020981]	Pa×s	[304.69; 586.18]
η	0.0020981	Pa×s	304.69	Joback Calculated Property
η	0.0012205	Pa×s	351.61	Joback Calculated Property
η	0.0008065	Pa×s	398.52	Joback Calculated Property
η	0.0005816	Pa×s	445.44	Joback Calculated Property
η	0.0004464	Pa×s	492.35	Joback Calculated Property
η	0.0003587	Pa×s	539.27	Joback Calculated Property
η	0.0002985	Pa×s	586.18	Joback Calculated Property

Similar Compounds

Find more compounds similar to 6,9-Guaiadiene.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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