Chemical Properties of Tricyclo[7.3.0.0(2.6)]dodecane, isomer # 3

InChI

InChI=1S/C12H20/c1-2-10-6-4-9-5-7-11(8-9)12(10)3-1/h9-12H,1-8H2

InChI Key

VDOTYUCOMJCUBP-UHFFFAOYSA-N

Formula

C12H20

SMILES

C1CC2CCC3CCC(C3)C2C1

Molecular Weight¹

164.29

• 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).
• IE : Ionization energy (eV).
• 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).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-129.34	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	16.01	kJ/mol	Joback Calculated Property
ΔvapH°	60.30	kJ/mol	Relay (1.0) Calculated Property
IE	9.11	eV	Relay (1.0) Calculated Property
logPoct/wat	3.613		Crippen Calculated Property
McVol	147.360	ml/mol	McGowan Calculated Property
Inp	[1307.00; 1326.00]
Inp	1307.00		NIST
Inp	1307.00		NIST
Inp	1326.00		NIST
I	[1477.00; 1508.00]
I	1477.00		NIST
I	1508.00		NIST
Tboil	507.14	K	Relay (1.0) Calculated Property
Tfus	320.31	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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	[369.34; 493.05]	J/mol×K	[502.52; 726.50]
Cp,gas	369.34	J/mol×K	502.52	Joback Calculated Property
Cp,gas	393.75	J/mol×K	539.85	Joback Calculated Property
Cp,gas	416.51	J/mol×K	577.18	Joback Calculated Property
Cp,gas	437.72	J/mol×K	614.51	Joback Calculated Property
Cp,gas	457.49	J/mol×K	651.84	Joback Calculated Property
Cp,gas	475.90	J/mol×K	689.17	Joback Calculated Property
Cp,gas	493.05	J/mol×K	726.50	Joback Calculated Property
η	[0.0009951; 0.0016617]	Pa×s	[264.02; 502.52]
η	0.0016617	Pa×s	264.02	Joback Calculated Property
η	0.0014426	Pa×s	303.77	Joback Calculated Property
η	0.0012941	Pa×s	343.52	Joback Calculated Property
η	0.0011873	Pa×s	383.27	Joback Calculated Property
η	0.0011071	Pa×s	423.02	Joback Calculated Property
η	0.0010448	Pa×s	462.77	Joback Calculated Property
η	0.0009951	Pa×s	502.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[7.3.0.0(2.6)]dodecane, isomer # 3.

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.
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