Chemical Properties of Cyclobutaneethanol, 1-methyl-2-(1-methylethenyl)-, trans- (CAS 30346-21-5)

InChI

InChI=1S/C10H18O/c1-8(2)9-4-5-10(9,3)6-7-11/h9,11H,1,4-7H2,2-3H3

InChI Key

SJKPJXGGNKMRPD-UHFFFAOYSA-N

Formula

C10H18O

SMILES

C=C(C)C1CCC1(C)CCO

Molecular Weight¹

154.25

CAS

30346-21-5

Other Names

• Cyclobutaneethanol, 2-isopropenyl-1-methyl-, stereoisomer
• Fragranol

• 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.
• 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°	11.24	kJ/mol	Joback Calculated Property
ΔfH°gas	-224.78	kJ/mol	Joback Calculated Property
ΔfusH°	13.96	kJ/mol	Joback Calculated Property
ΔvapH°	52.57	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	2853.57	kPa	Joback Calculated Property
Inp	[1196.00; 1221.60]
Inp	1220.00		NIST
Inp	1212.00		NIST
Inp	1221.60		NIST
Inp	1213.00		NIST
Inp	1196.00		NIST
I	1769.00		NIST
Tboil	523.52	K	Joback Calculated Property
Tc	710.61	K	Joback Calculated Property
Tfus	281.64	K	Joback Calculated Property
Vc	0.542	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[348.60; 425.00]	J/mol×K	[523.52; 710.61]
Cp,gas	348.60	J/mol×K	523.52	Joback Calculated Property
Cp,gas	363.16	J/mol×K	554.70	Joback Calculated Property
Cp,gas	376.87	J/mol×K	585.88	Joback Calculated Property
Cp,gas	389.82	J/mol×K	617.07	Joback Calculated Property
Cp,gas	402.10	J/mol×K	648.25	Joback Calculated Property
Cp,gas	413.80	J/mol×K	679.43	Joback Calculated Property
Cp,gas	425.00	J/mol×K	710.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclobutaneethanol, 1-methyl-2-(1-methylethenyl)-, trans-.

Sources

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

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