Chemical Properties of 2- hydroxy-2,6,6-trimethylcyclo-hexane- 1-carboxaldehyde

InChI

InChI=1S/C10H18O2/c1-9(2)5-4-6-10(3,12)8(9)7-11/h7-8,12H,4-6H2,1-3H3

InChI Key

HRPCKEAUAIGZEF-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

CC1(C)CCCC(C)(O)C1C=O

Molecular Weight¹

170.25

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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 : 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°	-204.97	kJ/mol	Joback Calculated Property
ΔfH°gas	-443.42	kJ/mol	Joback Calculated Property
ΔfusH°	9.41	kJ/mol	Joback Calculated Property
ΔvapH°	58.76	kJ/mol	Joback Calculated Property
log10WS	-2.08		Crippen Calculated Property
logPoct/wat	1.763		Crippen Calculated Property
McVol	148.340	ml/mol	McGowan Calculated Property
Pc	3145.56	kPa	Joback Calculated Property
I	[1860.00; 1860.00]
I	1860.00		NIST
I	1860.00		NIST
Tboil	579.73	K	Joback Calculated Property
Tc	783.69	K	Joback Calculated Property
Tfus	351.98	K	Joback Calculated Property
Vc	0.558	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[392.02; 472.80]	J/mol×K	[579.73; 783.69]
Cp,gas	392.02	J/mol×K	579.73	Joback Calculated Property
Cp,gas	407.02	J/mol×K	613.72	Joback Calculated Property
Cp,gas	421.19	J/mol×K	647.72	Joback Calculated Property
Cp,gas	434.70	J/mol×K	681.71	Joback Calculated Property
Cp,gas	447.70	J/mol×K	715.70	Joback Calculated Property
Cp,gas	460.35	J/mol×K	749.70	Joback Calculated Property
Cp,gas	472.80	J/mol×K	783.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2- hydroxy-2,6,6-trimethylcyclo-hexane- 1-carboxaldehyde.

Sources

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

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