Chemical Properties of 2-Cyclohexene-1-methanol, 2,6,6-trimethyl- (CAS 6627-74-3)

InChI

InChI=1S/C10H18O/c1-8-5-4-6-10(2,3)9(8)7-11/h5,9,11H,4,6-7H2,1-3H3

InChI Key

WFBRXMMODZGJPF-UHFFFAOYSA-N

Formula

C10H18O

SMILES

CC1=CCCC(C)(C)C1CO

Molecular Weight¹

154.25

CAS

6627-74-3

Other Names

• (2,6,6-Trimethyl-2-cyclohexen-1-yl)methanol
• «alpha»-Cyclogeraniol
• 2,6,6-Trimethylcyclohex-2-ene-1-methanol

• 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_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°	-71.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-306.43	kJ/mol	Joback Calculated Property
ΔfusH°	13.18	kJ/mol	Joback Calculated Property
ΔvapH°	54.46	kJ/mol	Joback Calculated Property
log10WS	-2.54		Crippen Calculated Property
logPoct/wat	2.361		Crippen Calculated Property
McVol	142.470	ml/mol	McGowan Calculated Property
Pc	2928.17	kPa	Joback Calculated Property
Inp	[1184.40; 1184.40]
Inp	1184.40		NIST
Inp	1184.40		NIST
Tboil	539.64	K	Joback Calculated Property
Tc	735.52	K	Joback Calculated Property
Tfus	303.60	K	Joback Calculated Property
Vc	0.530	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[350.85; 431.19]	J/mol×K	[539.64; 735.52]
Cp,gas	350.85	J/mol×K	539.64	Joback Calculated Property
Cp,gas	366.02	J/mol×K	572.29	Joback Calculated Property
Cp,gas	380.37	J/mol×K	604.93	Joback Calculated Property
Cp,gas	393.99	J/mol×K	637.58	Joback Calculated Property
Cp,gas	406.95	J/mol×K	670.22	Joback Calculated Property
Cp,gas	419.32	J/mol×K	702.87	Joback Calculated Property
Cp,gas	431.19	J/mol×K	735.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Cyclohexene-1-methanol, 2,6,6-trimethyl-.

Sources

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

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