Chemical Properties of «delta»-Terpineol (CAS 7299-42-5)

InChI

InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h9,11H,1,4-7H2,2-3H3

InChI Key

SQIFACVGCPWBQZ-UHFFFAOYSA-N

Formula

C10H18O

SMILES

C=C1CCC(C(C)(C)O)CC1

Molecular Weight¹

154.25

CAS

7299-42-5

Other Names

• «delta»-terpineol [=p-menth-1(7)-en-8-ol]
• «alpha»,«alpha»-dimethyl-4-methylenecyclohexanemethanol

• 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• 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°	9.01	kJ/mol	Joback Calculated Property
IE	9.04	eV	Relay (1.0) Calculated Property
logPoct/wat	2.504		Crippen Calculated Property
McVol	142.470	ml/mol	McGowan Calculated Property
Inp	[1134.00; 1187.00]
Inp	1166.00		NIST
Inp	1167.00		NIST
Inp	1166.00		NIST
Inp	1167.00		NIST
Inp	1167.00		NIST
Inp	1167.00		NIST
Inp	1145.00		NIST
Inp	1159.00		NIST
Inp	1166.00		NIST
Inp	1144.00		NIST
Inp	1162.00		NIST
Inp	1148.00		NIST
Inp	1175.00		NIST
Inp	1141.00		NIST
Inp	1141.00		NIST
Inp	1152.00		NIST
Inp	1143.00		NIST
Inp	1171.30		NIST
Inp	Outlier 1187.00		NIST
Inp	1164.00		NIST
Inp	1172.00		NIST
Inp	1170.00		NIST
Inp	1173.00		NIST
Inp	1166.00		NIST
Inp	1155.00		NIST
Inp	1152.00		NIST
Inp	1166.00		NIST
Inp	1162.00		NIST
Inp	1164.00		NIST
Inp	1153.00		NIST
Inp	1170.00		NIST
Inp	1169.00		NIST
Inp	1142.00		NIST
Inp	1166.00		NIST
Inp	1154.00		NIST
Inp	1166.00		NIST
Inp	1164.00		NIST
Inp	1142.00		NIST
Inp	1166.00		NIST
Inp	1169.00		NIST
Inp	1143.00		NIST
Inp	1157.00		NIST
Inp	1143.00		NIST
Inp	1153.00		NIST
Inp	1166.00		NIST
Inp	1147.00		NIST
Inp	1160.00		NIST
Inp	1165.00		NIST
Inp	1134.00		NIST
Inp	1166.00		NIST
Inp	1174.00		NIST
Inp	1170.00		NIST
Inp	1162.00		NIST
Inp	1134.00		NIST
Inp	1169.00		NIST
Inp	1134.00		NIST
Inp	1166.00		NIST
Inp	1146.00		NIST
Inp	1160.00		NIST
Inp	1134.00		NIST
Inp	1134.00		NIST
Inp	1148.00		NIST
Inp	1134.00		NIST
Inp	1152.00		NIST
Inp	1146.00		NIST
Inp	1166.00		NIST
Inp	1141.00		NIST
Inp	1164.00		NIST
Inp	1155.00		NIST
Inp	1153.00		NIST
Inp	1154.00		NIST
Inp	1169.00		NIST
Inp	1171.30		NIST
I	[1655.00; 1687.00]
I	1675.00		NIST
I	1667.00		NIST
I	1680.00		NIST
I	1678.00		NIST
I	1664.00		NIST
I	1680.00		NIST
I	1668.00		NIST
I	1684.00		NIST
I	1682.00		NIST
I	1687.00		NIST
I	1684.00		NIST
I	1687.00		NIST
I	1684.00		NIST
I	1687.00		NIST
I	1687.00		NIST
I	1687.00		NIST
I	1687.00		NIST
I	1687.00		NIST
I	1687.00		NIST
I	Outlier 1655.00		NIST
I	Outlier 1655.00		NIST
I	1682.00		NIST
I	1683.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	Outlier 1655.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1683.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1682.00		NIST
I	1684.00		NIST
I	1684.00		NIST
I	1664.00		NIST
I	1687.00		NIST
I	Outlier 1655.00		NIST
I	1682.00		NIST
Tboil	479.52	K	Relay (1.0) Calculated Property
Tfus	307.43	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[187.05; 508.54]	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			-6.87000e+01
Coefficient B			1.11824e+00
Coefficient C			-7.11000e-04
Coefficient D			1.70000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	187.05	J/mol×K	273.00	Calculated Property
Cp,gas	245.45	J/mol×K	353.78	Calculated Property
Cp,gas	296.92	J/mol×K	434.56	Calculated Property
Cp,gas	342.01	J/mol×K	515.33	Calculated Property
Cp,gas	381.25	J/mol×K	596.11	Calculated Property
Cp,gas	415.18	J/mol×K	676.89	Calculated Property
Cp,gas	444.34	J/mol×K	757.67	Calculated Property
Cp,gas	469.26	J/mol×K	838.44	Calculated Property
Cp,gas	490.48	J/mol×K	919.22	Calculated Property
Cp,gas	508.54	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0220163; 0.0001616]	Pa×s	[286.76; 514.48]	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			-1.49194e+01
Coefficient B			3.18402e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			286.76
Temperature range, max.			514.48
η	0.0220163	Pa×s	286.76	Calculated Property
η	0.0089488	Pa×s	312.06	Calculated Property
η	0.0041633	Pa×s	337.36	Calculated Property
η	0.0021551	Pa×s	362.67	Calculated Property
η	0.0012157	Pa×s	387.97	Calculated Property
η	0.0007355	Pa×s	413.27	Calculated Property
η	0.0004716	Pa×s	438.57	Calculated Property
η	0.0003174	Pa×s	463.87	Calculated Property
η	0.0002225	Pa×s	489.17	Calculated Property
η	0.0001616	Pa×s	514.48	Calculated Property

Similar Compounds

Find more compounds similar to «delta»-Terpineol.

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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