Chemical Properties of 2,2-dimethylcyclohexanol (CAS 1193-46-0)

InChI

InChI=1S/C8H16O/c1-8(2)6-4-3-5-7(8)9/h7,9H,3-6H2,1-2H3

InChI Key

BYBYZPFVXFPCND-UHFFFAOYSA-N

Formula

C8H16O

SMILES

CC1(C)CCCCC1O

Molecular Weight¹

128.21

CAS

1193-46-0

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_vap : Vapor pressure (kPa).
• 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

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, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[275.75; 354.91]	J/mol×K	[489.74; 687.88]
Cp,gas	275.75	J/mol×K	489.74	Joback Calculated Property
Cp,gas	290.94	J/mol×K	522.76	Joback Calculated Property
Cp,gas	305.22	J/mol×K	555.79	Joback Calculated Property
Cp,gas	318.68	J/mol×K	588.81	Joback Calculated Property
Cp,gas	331.39	J/mol×K	621.83	Joback Calculated Property
Cp,gas	343.44	J/mol×K	654.85	Joback Calculated Property
Cp,gas	354.91	J/mol×K	687.88	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[345.12; 488.89]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.50547e+01
Coefficient B			-4.11748e+03
Coefficient C			-6.62920e+01
Temperature range, min.			345.12
Temperature range, max.			488.89
Pvap	1.33	kPa	345.12	Calculated Property
Pvap	2.97	kPa	361.09	Calculated Property
Pvap	6.08	kPa	377.07	Calculated Property
Pvap	11.63	kPa	393.04	Calculated Property
Pvap	20.92	kPa	409.02	Calculated Property
Pvap	35.72	kPa	424.99	Calculated Property
Pvap	58.28	kPa	440.97	Calculated Property
Pvap	91.34	kPa	456.94	Calculated Property
Pvap	138.19	kPa	472.92	Calculated Property
Pvap	202.64	kPa	488.89	Calculated Property

Similar Compounds

Find more compounds similar to 2,2-dimethylcyclohexanol.

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
• The Yaws Handbook of Vapor Pressure

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.