Chemical Properties of 8-Acetoxycarvotanacetone (CAS 87578-93-6)

8-Acetoxycarvotanacetone

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InChI
InChI=1S/C12H18O3/c1-8-5-6-10(7-11(8)14)12(3,4)15-9(2)13/h5,10H,6-7H2,1-4H3
InChI Key
FTCAQUBXEGKQTD-UHFFFAOYSA-N
Formula
C12H18O3
SMILES
CC(=O)OC(C)(C)C1CC=C(C)C(=O)C1
Molecular Weight1
210.27
CAS
87578-93-6
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Physical Properties

Property Value Unit Source
Δf -258.73 kJ/mol Joback Calculated Property
Δfgas -581.63 kJ/mol Joback Calculated Property
Δfus 14.39 kJ/mol Joback Calculated Property
Δvap 55.80 kJ/mol Joback Calculated Property
log10WS -2.61 Crippen Calculated Property
logPoct/wat 2.253 Crippen Calculated Property
McVol 173.790 ml/mol McGowan Calculated Property
Pc 2393.53 kPa Joback Calculated Property
Inp 1571.70 NIST
Tboil 638.53 K Joback Calculated Property
Tc 865.73 K Joback Calculated Property
Tfus 388.46 K Joback Calculated Property
Vc 0.646 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [471.92; 562.59] J/mol×K [638.53; 865.73] Show Hide
Cp,gas 471.92 J/mol×K 638.53 Joback Calculated Property
Cp,gas 489.86 J/mol×K 676.40 Joback Calculated Property
Cp,gas 506.66 J/mol×K 714.26 Joback Calculated Property
Cp,gas 522.33 J/mol×K 752.13 Joback Calculated Property
Cp,gas 536.87 J/mol×K 790.00 Joback Calculated Property
Cp,gas 550.29 J/mol×K 827.86 Joback Calculated Property
Cp,gas 562.59 J/mol×K 865.73 Joback Calculated Property

Similar Compounds

S-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one. Terpinyl valerate. «alpha»-Terpinyl isovalerate. Carvotanacetone, 8-acetoxy. «alpha»-Terpinyl acetate. «alpha»-Terpinyl acetate. «alpha»-Bisabolol acetate. epi-«alpha»-Bisabolol, acetate. «alpha»-Bisabolol, acetate. (S)-2,2,6-Trimethyl-6-((S)-4-methylcyclohex-3-en-1-yl)dihydro-2H-pyran-3(4H)-one. trans-«beta»-Terpinyl butanoate. 3-Cyclohexene-1-methanol, «alpha»,«alpha»,4-trimethyl-, propanoate. Propanoic acid, 2-methyl-, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester. 2,2,6-Trimethyl-6-(4-methylcyclohex-3-en-1-yl)dihydro-2H-pyran-4(3H)-one. Menth-1-en-9-yl tiglate, p-.

Find more compounds similar to 8-Acetoxycarvotanacetone.

Sources

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