Chemical Properties of «delta»-Terpineol, acetate (CAS 93836-50-1)

InChI

InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h11H,1,5-8H2,2-4H3

InChI Key

IWKXKWUCSZHJEK-UHFFFAOYSA-N

Formula

C12H20O2

SMILES

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

Molecular Weight¹

196.29

CAS

93836-50-1

• 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).
• 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
ΔfG°	-103.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-406.00	kJ/mol	Joback Calculated Property
ΔfusH°	12.88	kJ/mol	Joback Calculated Property
ΔvapH°	50.75	kJ/mol	Joback Calculated Property
log10WS	-3.33		Crippen Calculated Property
logPoct/wat	3.075		Crippen Calculated Property
McVol	172.220	ml/mol	McGowan Calculated Property
Pc	2309.17	kPa	Joback Calculated Property
Inp	[1313.00; 1316.10]
Inp	1316.10		NIST
Inp	1316.10		NIST
Inp	1313.00		NIST
Tboil	565.73	K	Joback Calculated Property
Tc	778.96	K	Joback Calculated Property
Tfus	320.64	K	Joback Calculated Property
Vc	0.637	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[436.96; 535.11]	J/mol×K	[565.73; 778.96]
Cp,gas	436.96	J/mol×K	565.73	Joback Calculated Property
Cp,gas	456.01	J/mol×K	601.27	Joback Calculated Property
Cp,gas	473.94	J/mol×K	636.81	Joback Calculated Property
Cp,gas	490.78	J/mol×K	672.34	Joback Calculated Property
Cp,gas	506.57	J/mol×K	707.88	Joback Calculated Property
Cp,gas	521.33	J/mol×K	743.42	Joback Calculated Property
Cp,gas	535.11	J/mol×K	778.96	Joback Calculated Property
η	[0.0002027; 0.0031095]	Pa×s	[320.64; 565.73]
η	0.0031095	Pa×s	320.64	Joback Calculated Property
η	0.0015253	Pa×s	361.49	Joback Calculated Property
η	0.0008647	Pa×s	402.34	Joback Calculated Property
η	0.0005442	Pa×s	443.19	Joback Calculated Property
η	0.0003704	Pa×s	484.03	Joback Calculated Property
η	0.0002676	Pa×s	524.88	Joback Calculated Property
η	0.0002027	Pa×s	565.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to «delta»-Terpineol, acetate.

Sources

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

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