Chemical Properties of Bicyclo[3.1.0]hex-3-en-2-ol, 2-methyl-5-(1-methylethyl)-, (1«alpha»,2«alpha»,5«alpha»)- (CAS 97631-68-0)

InChI

InChI=1S/C10H16O/c1-7(2)10-5-4-9(3,11)8(10)6-10/h4-5,7-8,11H,6H2,1-3H3

InChI Key

MSEVJTQZWWZGMP-UHFFFAOYSA-N

Formula

C10H16O

SMILES

CC(C)C12C=CC(C)(O)C1C2

Molecular Weight¹

152.23

CAS

97631-68-0

Other Names

• 5-Isopropyl-2-methylbicyclo[3.1.0]hex-3-en-2-ol

• 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°	26.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-193.72	kJ/mol	Joback Calculated Property
ΔfusH°	8.19	kJ/mol	Joback Calculated Property
ΔvapH°	51.65	kJ/mol	Joback Calculated Property
log10WS	-2.30		Crippen Calculated Property
logPoct/wat	1.969		Crippen Calculated Property
McVol	131.610	ml/mol	McGowan Calculated Property
Pc	3360.64	kPa	Joback Calculated Property
Inp	[1039.00; 1039.00]
Inp	1039.00		NIST
Inp	1039.00		NIST
Tboil	528.39	K	Joback Calculated Property
Tc	728.63	K	Joback Calculated Property
Tfus	328.48	K	Joback Calculated Property
Vc	0.503	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[335.10; 406.12]	J/mol×K	[528.39; 728.63]
Cp,gas	335.10	J/mol×K	528.39	Joback Calculated Property
Cp,gas	349.04	J/mol×K	561.76	Joback Calculated Property
Cp,gas	361.87	J/mol×K	595.14	Joback Calculated Property
Cp,gas	373.80	J/mol×K	628.51	Joback Calculated Property
Cp,gas	385.01	J/mol×K	661.89	Joback Calculated Property
Cp,gas	395.72	J/mol×K	695.26	Joback Calculated Property
Cp,gas	406.12	J/mol×K	728.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[3.1.0]hex-3-en-2-ol, 2-methyl-5-(1-methylethyl)-, (1«alpha»,2«alpha»,5«alpha»)-.

Sources

• 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.