Chemical Properties of 1-Naphthalenol, decahydro-1,4a-dimethyl-7-(1-methylethylidene)-, [1R-(1«alpha»,4a«beta»,8a«alpha»)]- (CAS 473-04-1)

InChI

InChI=1S/C15H26O/c1-11(2)12-6-9-14(3)7-5-8-15(4,16)13(14)10-12/h13,16H,5-10H2,1-4H3/t13?,14-,15-/m1/s1

InChI Key

STRABSCAWZINIF-JVIGXAJISA-N

Formula

C15H26O

SMILES

CC(C)=C1CCC2(C)CCCC(C)(O)C2C1

Molecular Weight¹

222.37

CAS

473-04-1

Other Names

• Eudesm-7(11)-en-4-ol
• Juniper camphor
• 7(11)-Selinen-4«alpha»-ol
• 1-Naphthalenol, decahydro-1,4a-dimethyl-7-(1-methylethylidene)-, [1S-(1«alpha»,4a«beta»,8a«alpha»)]-
• (+)-Selin-7(11)-en-4«alpha»-ol

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.5041		Relay (1.0) Calculated Property
ΔfG°	29.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-295.04	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	14.05	kJ/mol	Joback Calculated Property
ΔvapH°	83.40	kJ/mol	Relay (1.0) Calculated Property
IE	8.22	eV	Relay (1.0) Calculated Property
log10WS	-3.29		Relay (1.0) Calculated Property
logPoct/wat	4.064		Crippen Calculated Property
McVol	202.060	ml/mol	McGowan Calculated Property
Pc	2235.52	kPa	Joback Calculated Property
Inp	[1642.00; 1741.00]
Inp	1682.00		NIST
Inp	1675.00		NIST
Inp	1688.00		NIST
Inp	1693.00		NIST
Inp	1688.00		NIST
Inp	1681.00		NIST
Inp	1700.00		NIST
Inp	1692.00		NIST
Inp	1690.00		NIST
Inp	1674.00		NIST
Inp	1678.00		NIST
Inp	1709.10		NIST
Inp	1700.00		NIST
Inp	1700.00		NIST
Inp	1700.00		NIST
Inp	1689.00		NIST
Inp	1702.00		NIST
Inp	1700.00		NIST
Inp	Outlier 1651.00		NIST
Inp	1701.00		NIST
Inp	Outlier 1651.00		NIST
Inp	1689.00		NIST
Inp	1695.00		NIST
Inp	Outlier 1647.00		NIST
Inp	1695.00		NIST
Inp	1700.00		NIST
Inp	1697.00		NIST
Inp	1700.00		NIST
Inp	1685.00		NIST
Inp	1690.00		NIST
Inp	1684.00		NIST
Inp	1700.00		NIST
Inp	1691.00		NIST
Inp	1700.00		NIST
Inp	1688.00		NIST
Inp	1675.00		NIST
Inp	Outlier 1741.00		NIST
Inp	1700.00		NIST
Inp	1685.00		NIST
Inp	Outlier 1642.00		NIST
Inp	1688.00		NIST
Inp	1692.00		NIST
Inp	1694.00		NIST
Inp	1689.00		NIST
Inp	1692.00		NIST
Inp	1700.00		NIST
Inp	1700.00		NIST
Inp	1697.00		NIST
Inp	1677.00		NIST
Inp	1680.00		NIST
Inp	1679.00		NIST
Inp	1680.00		NIST
Inp	1709.10		NIST
Inp	1700.00		NIST
Inp	1685.00		NIST
Inp	1689.00		NIST
Inp	1677.00		NIST
Inp	1682.00		NIST
I	[2239.00; 2325.00]
I	2302.00		NIST
I	2325.00		NIST
I	2271.00		NIST
I	2241.00		NIST
I	2239.00		NIST
I	2241.00		NIST
I	2320.00		NIST
I	2320.00		NIST
Tboil	564.06	K	Relay (1.0) Calculated Property
Tc	787.94	K	Relay (1.0) Calculated Property
Tfus	353.67	K	Relay (1.0) Calculated Property
Vc	0.698	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[592.41; 703.04]	J/mol×K	[667.67; 882.48]
Cp,gas	592.41	J/mol×K	667.67	Joback Calculated Property
Cp,gas	612.10	J/mol×K	703.47	Joback Calculated Property
Cp,gas	630.99	J/mol×K	739.27	Joback Calculated Property
Cp,gas	649.30	J/mol×K	775.07	Joback Calculated Property
Cp,gas	667.26	J/mol×K	810.88	Joback Calculated Property
Cp,gas	685.10	J/mol×K	846.68	Joback Calculated Property
Cp,gas	703.04	J/mol×K	882.48	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• 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.