Chemical Properties of Bicyclo[2.2.1]heptan-2-one, 1,4,7,7-tetramethyl- (CAS 10309-50-9)

InChI

InChI=1S/C11H18O/c1-9(2)10(3)5-6-11(9,4)8(12)7-10/h5-7H2,1-4H3

InChI Key

WHTUSNIUKHUYQX-UHFFFAOYSA-N

Formula

C11H18O

SMILES

CC12CCC(C)(C(=O)C1)C2(C)C

Molecular Weight¹

166.26

CAS

10309-50-9

Other Names

• 1,4,7,7-Tetramethylbicyclo[2.2.1]heptan-2-one
• 4-Methylcamphor
• 2-Norbornanone, 1,4,7,7-tetramethyl-

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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 formation at standard conditions, 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	[370.97; 468.43]	J/mol×K	[532.90; 771.52]
Cp,gas	370.97	J/mol×K	532.90	Joback Calculated Property
Cp,gas	389.69	J/mol×K	572.67	Joback Calculated Property
Cp,gas	406.89	J/mol×K	612.44	Joback Calculated Property
Cp,gas	422.97	J/mol×K	652.21	Joback Calculated Property
Cp,gas	438.33	J/mol×K	691.98	Joback Calculated Property
Cp,gas	453.35	J/mol×K	731.75	Joback Calculated Property
Cp,gas	468.43	J/mol×K	771.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]heptan-2-one, 1,4,7,7-tetramethyl-.

Sources

• Cheméo Relay (1.0)
• 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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