Chemical Properties of 3-Isothujone

3-Isothujone

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InChI
InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1
InChI Key
USMNOWBWPHYOEA-MRTMQBJTSA-N
Formula
C10H16O
SMILES
CC1C(=O)CC2(C(C)C)CC12
Molecular Weight1
152.23
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Physical Properties

Property Value Unit Source
Δf 16.59 kJ/mol Joback Calculated Property
Δfgas -252.21 kJ/mol Joback Calculated Property
Δfus 8.69 kJ/mol Joback Calculated Property
Δvap 40.08 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 2881.21 kPa Joback Calculated Property
Inp 1103.00 NIST
I 1440.00 NIST
Tboil 504.63 K Joback Calculated Property
Tc 724.49 K Joback Calculated Property
Tfus 311.22 K Joback Calculated Property
Vc 0.507 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [324.27; 416.01] J/mol×K [504.63; 724.49] Show Hide
Cp,gas 324.27 J/mol×K 504.63 Joback Calculated Property
Cp,gas 342.10 J/mol×K 541.27 Joback Calculated Property
Cp,gas 358.73 J/mol×K 577.92 Joback Calculated Property
Cp,gas 374.30 J/mol×K 614.56 Joback Calculated Property
Cp,gas 388.94 J/mol×K 651.20 Joback Calculated Property
Cp,gas 402.80 J/mol×K 687.84 Joback Calculated Property
Cp,gas 416.01 J/mol×K 724.49 Joback Calculated Property

Similar Compounds

Thujone. Bicyclo[3.1.0]hexan-3-one, 4-methyl-1-(1-methylethyl)-, [1S-(1«alpha»,4«beta»,5«alpha»)]-. Bicyclo[3.1.0]hexan-3-one, 4-methyl-1-(1-methylethyl)-. iso-3-Thujone. 3-thujopsanone. 3-Thujopsanone. Thujopsa-3-one. Methyl sabinaketone. Bicyclo[3.1.0]hexan-2-one, 5-(1-methylethyl)-. 1,10-seco-Aromadendran-1,10-dione. 5-epi-1,10-seco-Aromadendran-1,10-dione. Isocamphenone, endo-. 4,5-seco-Africanan-4,5-dione. Bicyclo[4.1.0]heptan-3-one, 4,7,7-trimethyl-, [1R-(1«alpha»,4«alpha»,6«alpha»)]-. Cycloandrostan-6,17-dione, 3alpha,5alpha-.

Find more compounds similar to 3-Isothujone.

Sources

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