Chemical Properties of Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl- (CAS 18358-53-7)

Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-

PDF Excel Molecule Calculator
InChI
InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3
InChI Key
MQPHVIPKLRXGDJ-UHFFFAOYSA-N
Formula
C10H16O
SMILES
CC1C(=O)CC2CC1C2(C)C
Molecular Weight1
152.23
CAS
18358-53-7
Other Names
  • 2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
  • D-Pinocamphone
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -0.78 kJ/mol Joback Calculated Property
Δfgas -273.43 kJ/mol Joback Calculated Property
Δfus 11.18 kJ/mol Joback Calculated Property
Δvap 40.33 kJ/mol Joback Calculated Property
log10WS -2.11 Crippen Calculated Property
logPoct/wat 2.258 Crippen Calculated Property
McVol 131.610 ml/mol McGowan Calculated Property
Pc 2832.35 kPa Joback Calculated Property
Inp [205.22; 1176.00]   Show Hide
Inp 1160.00 NIST
Inp 1176.00 NIST
Inp 1167.00 NIST
Inp 1160.00 NIST
Inp 205.22 NIST
Inp 205.22 NIST
Inp 1160.00 NIST
Tboil 504.67 K Joback Calculated Property
Tc 727.60 K Joback Calculated Property
Tfus 318.46 K Joback Calculated Property
Vc 0.504 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [324.94; 422.45] J/mol×K [504.67; 727.60] Show Hide
Cp,gas 324.94 J/mol×K 504.67 Joback Calculated Property
Cp,gas 343.76 J/mol×K 541.83 Joback Calculated Property
Cp,gas 361.40 J/mol×K 578.98 Joback Calculated Property
Cp,gas 377.96 J/mol×K 616.14 Joback Calculated Property
Cp,gas 393.57 J/mol×K 653.29 Joback Calculated Property
Cp,gas 408.36 J/mol×K 690.45 Joback Calculated Property
Cp,gas 422.45 J/mol×K 727.60 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-.

Sources

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.