Chemical Properties of (6R,7S,8S)-8-(4-Hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol (CAS 36531-08-5)

InChI

InChI=1S/C20H24O4/c1-11-7-14-9-19(24-4)17(22)10-15(14)20(12(11)2)13-5-6-16(21)18(8-13)23-3/h5-6,8-12,20-22H,7H2,1-4H3

InChI Key

TZAAYUCUPIYQBR-UHFFFAOYSA-N

Formula

C20H24O4

SMILES

COc1cc(C2c3cc(O)c(OC)cc3CC(C)C2C)ccc1O

Molecular Weight¹

328.40

CAS

36531-08-5

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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.
• 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	0.8811		Relay (... Calculated Property
ΔfG°	-172.56	kJ/mol	Joback Calculated Property
ΔfH°gas	-506.41	kJ/mol	Relay (... Calculated Property
ΔfusH°	46.59	kJ/mol	Joback Calculated Property
ΔvapH°	136.43	kJ/mol	Relay (... Calculated Property
IE	7.51	eV	Relay (... Calculated Property
log10WS	-4.22		Relay (... Calculated Property
logPoct/wat	4.075		Crippen Calculated Property
McVol	257.760	ml/mol	McGowan Calculated Property
Pc	2127.56	kPa	Joback Calculated Property
Inp	[2738.30; 2738.30]
Inp	2738.30		NIST
Inp	2738.30		NIST
Tboil	665.46	K	Relay (... Calculated Property
Tc	987.95	K	Relay (... Calculated Property
Tfus	453.86	K	Relay (... Calculated Property
Vc	0.901	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[854.14; 949.47]	J/mol×K	[933.05; 1177.77]
Cp,gas	854.14	J/mol×K	933.05	Joback Calculated Property
Cp,gas	871.11	J/mol×K	973.84	Joback Calculated Property
Cp,gas	887.44	J/mol×K	1014.62	Joback Calculated Property
Cp,gas	903.29	J/mol×K	1055.41	Joback Calculated Property
Cp,gas	918.81	J/mol×K	1096.19	Joback Calculated Property
Cp,gas	934.16	J/mol×K	1136.98	Joback Calculated Property
Cp,gas	949.47	J/mol×K	1177.77	Joback Calculated Property
η	[0.0000004; 0.0000052]	Pa×s	[679.40; 933.05]
η	0.0000052	Pa×s	679.40	Joback Calculated Property
η	0.0000029	Pa×s	721.68	Joback Calculated Property
η	0.0000018	Pa×s	763.95	Joback Calculated Property
η	0.0000011	Pa×s	806.23	Joback Calculated Property
η	0.0000008	Pa×s	848.50	Joback Calculated Property
η	0.0000005	Pa×s	890.78	Joback Calculated Property
η	0.0000004	Pa×s	933.05	Joback Calculated Property

Similar Compounds

Find more compounds similar to (6R,7S,8S)-8-(4-Hydroxy-3-methoxyphenyl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol.

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.