Chemical Properties of Bicyclo[3.1.1]heptan-3-one, 6,6-dimethyl-2-(2-methylpropyl)-

Bicyclo[3.1.1]heptan-3-one, 6,6-dimethyl-2-(2-methylpropyl)-

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InChI
InChI=1S/C13H22O/c1-8(2)5-10-11-6-9(7-12(10)14)13(11,3)4/h8-11H,5-7H2,1-4H3
InChI Key
BLQUUSSRJOLJLD-UHFFFAOYSA-N
Formula
C13H22O
SMILES
CC(C)CC1C(=O)CC2CC1C2(C)C
Molecular Weight1
194.31
Other Names
  • 6,6-Dimethyl-2-(2-methylpropyl)-bicyclo[3.1.1]heptan-3-one (isomer)
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Physical Properties

Property Value Unit Source
Δf 22.04 kJ/mol Joback Calculated Property
Δfgas -340.63 kJ/mol Joback Calculated Property
Δfus 15.43 kJ/mol Joback Calculated Property
Δvap 46.62 kJ/mol Joback Calculated Property
log10WS -3.13 Crippen Calculated Property
logPoct/wat 3.284 Crippen Calculated Property
McVol 173.880 ml/mol McGowan Calculated Property
Pc 2145.33 kPa Joback Calculated Property
Inp 1237.00 NIST
Tboil 572.87 K Joback Calculated Property
Tc 789.25 K Joback Calculated Property
Tfus 337.27 K Joback Calculated Property
Vc 0.666 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [472.83; 583.47] J/mol×K [572.87; 789.25] Show Hide
Cp,gas 472.83 J/mol×K 572.87 Joback Calculated Property
Cp,gas 493.81 J/mol×K 608.93 Joback Calculated Property
Cp,gas 513.61 J/mol×K 645.00 Joback Calculated Property
Cp,gas 532.35 J/mol×K 681.06 Joback Calculated Property
Cp,gas 550.16 J/mol×K 717.12 Joback Calculated Property
Cp,gas 567.16 J/mol×K 753.18 Joback Calculated Property
Cp,gas 583.47 J/mol×K 789.25 Joback Calculated Property

Similar Compounds

[1S-(1«alpha»,2«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one. Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, (1«alpha»,2«alpha»,5«alpha»)-. (E)-Pinanone. S-pinocamphone. cis-Pinocamphone. Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-. [1R-(1«alpha»,2«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one. (Z)-Pinocamphone. pinocamphone isomer (T). Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, (1«alpha»,2«beta»,5«alpha»)-. verbanone. endo-1-bourbonanone. 11-Norbourbonan-1-one. Norbourbonone. Bicyclo[3.1.1]heptan-2-one, 3,6,6-trimethyl-.

Find more compounds similar to Bicyclo[3.1.1]heptan-3-one, 6,6-dimethyl-2-(2-methylpropyl)-.

Sources

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