Chemical Properties of Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl- (CAS 55976-09-5)

InChI

InChI=1S/C12H20/c1-10-6-5-9-12(2)8-4-3-7-11(10)12/h6,11H,3-5,7-9H2,1-2H3

InChI Key

NNSQRLUGFFCDCI-UHFFFAOYSA-N

Formula

C12H20

SMILES

CC1=CCCC2(C)CCCCC12

Molecular Weight¹

164.29

CAS

55976-09-5

Other Names

• 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethylnaphthalene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	9.24	kJ/mol	Joback Calculated Property
IE	8.38	eV	Relay (1.0) Calculated Property
logPoct/wat	3.923		Crippen Calculated Property
McVol	153.920	ml/mol	McGowan Calculated Property
I	[1685.00; 1685.00]
I	1685.00		NIST
I	1685.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[367.28; 479.66]	J/mol×K	[509.10; 737.29]
Cp,gas	367.28	J/mol×K	509.10	Joback Calculated Property
Cp,gas	389.34	J/mol×K	547.13	Joback Calculated Property
Cp,gas	409.86	J/mol×K	585.16	Joback Calculated Property
Cp,gas	428.99	J/mol×K	623.20	Joback Calculated Property
Cp,gas	446.89	J/mol×K	661.23	Joback Calculated Property
Cp,gas	463.73	J/mol×K	699.26	Joback Calculated Property
Cp,gas	479.66	J/mol×K	737.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-.

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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