Chemical Properties of Naphthalene, decahydro-1,8a-dimethyl-7-(1-methylethyl)-, [1R-(1«alpha»,4a«beta»,7«beta»,8a«alpha»)]- (CAS 15404-63-4)

InChI

InChI=1S/C15H28/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h11-14H,5-10H2,1-4H3

InChI Key

AJWBFJHTFGRNDG-UHFFFAOYSA-N

Formula

C15H28

SMILES

CC(C)C1CCC2CCCC(C)C2(C)C1

Molecular Weight¹

208.38

CAS

15404-63-4

Other Names

• 4«beta»H,5«alpha»-Eremophilane
• Nootkatane, (+)-
• Naphthalene, decahydro-1,8a-dimethyl-7-(1-methylethyl)-
• Valencane
• Nootkatane

• 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.
• 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
ΔfG°	125.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-262.69	kJ/mol	Joback Calculated Property
ΔfusH°	14.80	kJ/mol	Joback Calculated Property
ΔvapH°	47.34	kJ/mol	Joback Calculated Property
log10WS	-4.68		Crippen Calculated Property
logPoct/wat	4.885		Crippen Calculated Property
McVol	200.490	ml/mol	McGowan Calculated Property
Pc	1872.41	kPa	Joback Calculated Property
Inp	[1493.00; 1493.00]
Inp	1493.00		NIST
Inp	1493.00		NIST
I	1624.00		NIST
Tboil	563.62	K	Joback Calculated Property
Tc	781.30	K	Joback Calculated Property
Tfus	281.03	K	Joback Calculated Property
Vc	0.748	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[539.93; 675.83]	J/mol×K	[563.62; 781.30]
Cp,gas	539.93	J/mol×K	563.62	Joback Calculated Property
Cp,gas	566.03	J/mol×K	599.90	Joback Calculated Property
Cp,gas	590.56	J/mol×K	636.18	Joback Calculated Property
Cp,gas	613.67	J/mol×K	672.46	Joback Calculated Property
Cp,gas	635.49	J/mol×K	708.74	Joback Calculated Property
Cp,gas	656.17	J/mol×K	745.02	Joback Calculated Property
Cp,gas	675.83	J/mol×K	781.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, decahydro-1,8a-dimethyl-7-(1-methylethyl)-, [1R-(1«alpha»,4a«beta»,7«beta»,8a«alpha»)]-.

Sources

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

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