Chemical Properties of Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, [1S-(1«alpha»,2«beta»,3«alpha»,5«alpha»)]- (CAS 24041-60-9)

InChI

InChI=1S/C12H22O/c1-8-9(13)6-11(4)7-12(8,5)10(11,2)3/h8-9,13H,6-7H2,1-5H3/t8-,9+,11+,12+/m0/s1

InChI Key

NJBQFUAXCUCPGX-LUTQBAROSA-N

Formula

C10H18O

SMILES

CC1C(O)CC2(C)CC1(C)C2(C)C

Molecular Weight¹

154.25

CAS

24041-60-9

Other Names

• (+)-Isopinocampheol
• [1S-(1«alpha»,2«beta»,3«alpha»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization 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	[451.67; 543.82]	J/mol×K	[570.80; 773.55]
Cp,gas	451.67	J/mol×K	570.80	Joback Calculated Property
Cp,gas	468.76	J/mol×K	604.59	Joback Calculated Property
Cp,gas	484.81	J/mol×K	638.38	Joback Calculated Property
Cp,gas	500.08	J/mol×K	672.17	Joback Calculated Property
Cp,gas	514.84	J/mol×K	705.96	Joback Calculated Property
Cp,gas	529.33	J/mol×K	739.75	Joback Calculated Property
Cp,gas	543.82	J/mol×K	773.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, [1S-(1«alpha»,2«beta»,3«alpha»,5«alpha»)]-.

Sources

• 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
• NIST Webbook

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