Chemical Properties of neo-3-thujyl acetate

neo-3-thujyl acetate

PDF Excel Molecule Calculator
InChI
InChI=1S/C12H20O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7-8,10-11H,5-6H2,1-4H3
InChI Key
RYMWIDNPMDLHRP-UHFFFAOYSA-N
Formula
C12H20O2
SMILES
CC(=O)OC1CC2(C(C)C)CC2C1C
Molecular Weight1
196.29
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 -85.61 kJ/mol Joback Calculated Property
Δfgas -420.93 kJ/mol Joback Calculated Property
Δfus 18.21 kJ/mol Joback Calculated Property
Δvap 49.13 kJ/mol Joback Calculated Property
log10WS -2.64 Crippen Calculated Property
logPoct/wat 2.620 Crippen Calculated Property
McVol 165.660 ml/mol McGowan Calculated Property
Pc 2318.07 kPa Joback Calculated Property
Inp [1252.00; 1267.00]   Show Hide
Inp 1267.00 NIST
Inp 1252.00 NIST
Inp 1261.00 NIST
Tboil 554.19 K Joback Calculated Property
Tc 758.84 K Joback Calculated Property
Tfus 333.46 K Joback Calculated Property
Vc 0.635 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [438.10; 534.06] J/mol×K [554.19; 758.84] Show Hide
Cp,gas 438.10 J/mol×K 554.19 Joback Calculated Property
Cp,gas 456.42 J/mol×K 588.30 Joback Calculated Property
Cp,gas 473.65 J/mol×K 622.41 Joback Calculated Property
Cp,gas 489.90 J/mol×K 656.52 Joback Calculated Property
Cp,gas 505.31 J/mol×K 690.62 Joback Calculated Property
Cp,gas 519.99 J/mol×K 724.73 Joback Calculated Property
Cp,gas 534.06 J/mol×K 758.84 Joback Calculated Property

Similar Compounds

3-Isothujyl acetate. Thujyl acetate. neo-iso-3-Thujyl acetate. iso-3-Thujyl acetate. (1R,3R,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel. (1R,3S,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel-. 24(28)-Dihydrocycloeucalenol acetate. 9,19-Cyclolanostan-3-ol, acetate, (3«beta»)-. 31-Norcycloartanol acetate. 24-Methylcycloartanol acetate. 24-Methyl-31-nor-23-dehydrocycloartanol acetate. 5«alpha»-Cholestan-3«alpha»-ol, 4«alpha»-methyl-, acetate. exo-Pinocampheol, acetate. endo-Pinocampheol, acetate. Pinocampheyl acetate.

Find more compounds similar to neo-3-thujyl acetate.

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.