Chemical Properties of «alpha»-Terpinyl acetate (CAS 8007-35-0)

InChI

InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3

InChI Key

IGODOXYLBBXFDW-UHFFFAOYSA-N

Formula

C12H20O2

SMILES

CC(=O)OC(C)(C)C1CC=C(C)CC1

Molecular Weight¹

196.29

CAS

8007-35-0

Other Names

• Terpineol, acetate
• p-ment-1-en-8-yl acetate

• 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).
• 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).
• 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°	16.46	kJ/mol	Joback Calculated Property
ΔvapH°	66.29	kJ/mol	Relay (1.0) Calculated Property
IE	8.46	eV	Relay (1.0) Calculated Property
log10WS	-2.75		Relay (1.0) Calculated Property
logPoct/wat	3.075		Crippen Calculated Property
McVol	172.220	ml/mol	McGowan Calculated Property
Inp	[1329.00; 1356.00]
Inp	1354.00		NIST
Inp	1356.00		NIST
Inp	1350.00		NIST
Inp	1351.00		NIST
Inp	1350.00		NIST
Inp	1350.00		NIST
Inp	1333.00		NIST
Inp	Outlier 1329.00		NIST
Inp	1350.00		NIST
I	[1679.00; 1709.00]
I	1679.00		NIST
I	1709.00		NIST
I	1709.00		NIST
I	1679.00		NIST
I	1709.00		NIST
Tboil	501.30	K	Relay (1.0) Calculated Property
Tfus	240.53	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 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[431.32; 530.33]	J/mol×K	[552.84; 764.86]
Cp,gas	431.32	J/mol×K	552.84	Joback Calculated Property
Cp,gas	450.63	J/mol×K	588.18	Joback Calculated Property
Cp,gas	468.76	J/mol×K	623.51	Joback Calculated Property
Cp,gas	485.77	J/mol×K	658.85	Joback Calculated Property
Cp,gas	501.67	J/mol×K	694.18	Joback Calculated Property
Cp,gas	516.52	J/mol×K	729.52	Joback Calculated Property
Cp,gas	530.33	J/mol×K	764.86	Joback Calculated Property
η	[0.0001689; 0.0048018]	Pa×s	[290.41; 552.84]
η	0.0048018	Pa×s	290.41	Joback Calculated Property
η	0.0019078	Pa×s	334.15	Joback Calculated Property
η	0.0009386	Pa×s	377.89	Joback Calculated Property
η	0.0005350	Pa×s	421.62	Joback Calculated Property
η	0.0003389	Pa×s	465.36	Joback Calculated Property
η	0.0002322	Pa×s	509.10	Joback Calculated Property
η	0.0001689	Pa×s	552.84	Joback Calculated Property

Similar Compounds

Find more compounds similar to «alpha»-Terpinyl acetate.

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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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