Chemical Properties of Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, (1«alpha»,2«beta»,3«alpha»,5«alpha»)- (CAS 27779-29-9)

Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, (1«alpha»,2«beta»,3«alpha»,5«alpha»)-

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InChI
InChI=1S/C10H18O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-9,11H,4-5H2,1-3H3
InChI Key
REPVLJRCJUVQFA-UHFFFAOYSA-N
Formula
C10H18O
SMILES
CC1C(O)CC2CC1C2(C)C
Molecular Weight1
154.25
CAS
27779-29-9
Other Names
  • 3-Pinanol, stereoisomer
  • Isopinocampheol
  • 2,6,6-Trimethylbicyclo[3.1.1]heptan-3-ol-, (1R,2R,3R,5S)-rel-
  • (1«alpha»,2«beta»,3«alpha»,5«alpha»)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol
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Physical Properties

Property Value Unit Source
Δf -22.72 kJ/mol Joback Calculated Property
Δfgas -308.30 kJ/mol Joback Calculated Property
Δfus 16.83 kJ/mol Joback Calculated Property
Δvap 52.45 kJ/mol Joback Calculated Property
log10WS -2.21 Crippen Calculated Property
logPoct/wat 2.049 Crippen Calculated Property
McVol 135.910 ml/mol McGowan Calculated Property
Pc 2906.11 kPa Joback Calculated Property
Inp [1120.00; 1190.00]   Show Hide
Inp 1120.00 NIST
Inp 1162.00 NIST
Inp 1178.00 NIST
Inp 1180.00 NIST
Inp 1190.00 NIST
Inp 1168.00 NIST
Inp 1168.00 NIST
Inp 1170.00 NIST
Inp 1190.00 NIST
Inp 1120.00 NIST
I [1676.00; 1716.00]   Show Hide
I 1716.00 NIST
I 1703.00 NIST
I 1676.00 NIST
I 1676.00 NIST
Tboil 492.20 K NIST
Tc 717.42 K Joback Calculated Property
Tfus 306.82 K Joback Calculated Property
Vc 0.515 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [355.48; 441.78] J/mol×K [524.36; 717.42] Show Hide
Cp,gas 355.48 J/mol×K 524.36 Joback Calculated Property
Cp,gas 372.00 J/mol×K 556.54 Joback Calculated Property
Cp,gas 387.53 J/mol×K 588.71 Joback Calculated Property
Cp,gas 402.17 J/mol×K 620.89 Joback Calculated Property
Cp,gas 416.03 J/mol×K 653.07 Joback Calculated Property
Cp,gas 429.20 J/mol×K 685.24 Joback Calculated Property
Cp,gas 441.78 J/mol×K 717.42 Joback Calculated Property

Similar Compounds

[1R-(1«alpha»,2«beta»,3«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol. [1R-(1«alpha»,2«alpha»,3«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol. Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, [1R-(1«alpha»,2«beta»,3«alpha»,5«alpha»)]-. Dehydroisocarveol. neo-Verbanol. NSC 408941. Neo iso-verbanol. Verbanol. Isoverbanol. Dihydro-cis-«alpha»-copaene-8-ol. 1-endo-Boubonanol. Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, [1S-(1«alpha»,2«beta»,3«alpha»,5«alpha»)]-. Cholestan-3-ol, 4-methyl-, (3«beta»,4«alpha»,5«alpha»)-. 2-Norpinanol, 3,6,6-trimethyl-. 5-Isocedranol.

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

Sources

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