Chemical Properties of 1,4-Cyclohexadiene-1-methanol, 4-(1-methylethyl)- (CAS 22539-72-6)

InChI

InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,6,8,11H,4-5,7H2,1-2H3

InChI Key

IRZQJXCCKXGQFV-UHFFFAOYSA-N

Formula

C10H16O

SMILES

CC(C)C1=CCC(CO)=CC1

Molecular Weight¹

152.23

CAS

22539-72-6

Other Names

• p-Mentha-1,4-dien-7-ol
• 1,4-p-Menthadien-7-ol
• 1-Methoxy-4-1(methyl ethyl)-cyclohexane-1,4-dione

• 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.
• I : 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	0.4945		Relay (... Calculated Property
ΔfG°	-33.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-121.80	kJ/mol	Relay (... Calculated Property
ΔfusH°	14.65	kJ/mol	Joback Calculated Property
ΔvapH°	77.94	kJ/mol	Relay (... Calculated Property
IE	8.54	eV	Relay (... Calculated Property
log10WS	-2.21		Relay (... Calculated Property
logPoct/wat	2.281		Crippen Calculated Property
McVol	138.170	ml/mol	McGowan Calculated Property
Pc	3093.29	kPa	Joback Calculated Property
Inp	[1315.00; 1333.00]
Inp	1333.00		NIST
Inp	1329.50		NIST
Inp	1332.00		NIST
Inp	1315.00		NIST
Inp	1315.00		NIST
I	[2065.00; 2073.00]
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	Outlier 2065.00		NIST
I	2073.00		NIST
I	2073.00		NIST
I	2073.00		NIST
Tboil	502.04	K	Relay (... Calculated Property
Tc	705.85	K	Relay (... Calculated Property
Tfus	311.47	K	Relay (... Calculated Property
Vc	0.468	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[330.66; 402.32]	J/mol×K	[552.44; 748.10]
Cp,gas	330.66	J/mol×K	552.44	Joback Calculated Property
Cp,gas	344.29	J/mol×K	585.05	Joback Calculated Property
Cp,gas	357.21	J/mol×K	617.66	Joback Calculated Property
Cp,gas	369.45	J/mol×K	650.27	Joback Calculated Property
Cp,gas	381.03	J/mol×K	682.88	Joback Calculated Property
Cp,gas	391.98	J/mol×K	715.49	Joback Calculated Property
Cp,gas	402.32	J/mol×K	748.10	Joback Calculated Property
η	[0.0000941; 0.0168754]	Pa×s	[286.46; 552.44]
η	0.0168754	Pa×s	286.46	Joback Calculated Property
η	0.0039809	Pa×s	330.79	Joback Calculated Property
η	0.0013212	Pa×s	375.12	Joback Calculated Property
η	0.0005536	Pa×s	419.45	Joback Calculated Property
η	0.0002739	Pa×s	463.78	Joback Calculated Property
η	0.0001533	Pa×s	508.11	Joback Calculated Property
η	0.0000941	Pa×s	552.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,4-Cyclohexadiene-1-methanol, 4-(1-methylethyl)-.

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