Chemical Properties of 8-Hydroxy-6,7-dihydrolinalool

InChI

InChI=1S/C10H20O2/c1-4-10(3,12)7-5-6-9(2)8-11/h4,9,11-12H,1,5-8H2,2-3H3

InChI Key

GFOMTORUAWAGGU-UHFFFAOYSA-N

Formula

C10H20O2

SMILES

C=CC(C)(O)CCCC(C)CO

Molecular Weight¹

172.27

Other Names

• 2,6-dimethyl-7-octene- 1,6-diol
• 8-Hydroxy-6,7-dihydrolinalol
• 2,6-Dimethyl-oct-7-en-1,6-diol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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
ΔfusH°	17.61	kJ/mol	Joback Calculated Property
ΔvapH°	87.17	kJ/mol	Relay (1.0) Calculated Property
log10WS	-1.18		Relay (1.0) Calculated Property
logPoct/wat	1.722		Crippen Calculated Property
McVol	159.200	ml/mol	McGowan Calculated Property
I	[2184.00; 2220.00]
I	2220.00		NIST
I	2209.00		NIST
I	2184.00		NIST
I	2220.00		NIST
Tboil	520.45	K	Relay (1.0) Calculated Property
Tfus	276.65	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[231.04; 546.07]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-2.47660e+01
Coefficient B			1.13354e+00
Coefficient C			-7.78900e-04
Coefficient D			2.16200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	231.04	J/mol×K	273.00	Calculated Property
Cp,gas	288.34	J/mol×K	353.78	Calculated Property
Cp,gas	338.48	J/mol×K	434.56	Calculated Property
Cp,gas	382.12	J/mol×K	515.33	Calculated Property
Cp,gas	419.97	J/mol×K	596.11	Calculated Property
Cp,gas	452.69	J/mol×K	676.89	Calculated Property
Cp,gas	480.98	J/mol×K	757.67	Calculated Property
Cp,gas	505.52	J/mol×K	838.44	Calculated Property
Cp,gas	526.99	J/mol×K	919.22	Calculated Property
Cp,gas	546.07	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0575569; 0.0000658]	Pa×s	[309.76; 541.39]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.86879e+01
Coefficient B			4.90442e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			309.76
Temperature range, max.			541.39
η	0.0575569	Pa×s	309.76	Calculated Property
η	0.0170850	Pa×s	335.50	Calculated Property
η	0.0060297	Pa×s	361.23	Calculated Property
η	0.0024442	Pa×s	386.97	Calculated Property
η	0.0011089	Pa×s	412.71	Calculated Property
η	0.0005520	Pa×s	438.44	Calculated Property
η	0.0002969	Pa×s	464.18	Calculated Property
η	0.0001704	Pa×s	489.92	Calculated Property
η	0.0001034	Pa×s	515.65	Calculated Property
η	0.0000658	Pa×s	541.39	Calculated Property

Similar Compounds

Find more compounds similar to 8-Hydroxy-6,7-dihydrolinalool.

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

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