Chemical Properties of «beta»-Isocyclolavandulyl acetate

«beta»-Isocyclolavandulyl acetate

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InChI
InChI=1S/C12H20O2/c1-9-7-12(3,4)6-5-11(9)8-14-10(2)13/h5,9H,6-8H2,1-4H3/t9-/m0/s1
InChI Key
QHJKSPVTMXZZCA-VIFPVBQESA-N
Formula
C12H20O2
SMILES
CC(=O)OCC1=CCC(C)(C)CC1C
Molecular Weight1
196.29
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Physical Properties

Property Value Unit Source
Δf -152.18 kJ/mol Joback Calculated Property
Δfgas -440.28 kJ/mol Joback Calculated Property
Δfus 17.06 kJ/mol Joback Calculated Property
Δvap 51.39 kJ/mol Joback Calculated Property
log10WS -2.97 Crippen Calculated Property
logPoct/wat 2.932 Crippen Calculated Property
McVol 172.220 ml/mol McGowan Calculated Property
Pc 2298.11 kPa Joback Calculated Property
Inp [1283.00; 1283.00]   Show Hide
Inp 1283.00 NIST
Inp 1283.00 NIST
I 1634.00 NIST
Tboil 569.51 K Joback Calculated Property
Tc 779.44 K Joback Calculated Property
Tfus 337.48 K Joback Calculated Property
Vc 0.647 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [434.86; 530.36] J/mol×K [569.51; 779.44] Show Hide
Cp,gas 434.86 J/mol×K 569.51 Joback Calculated Property
Cp,gas 452.86 J/mol×K 604.50 Joback Calculated Property
Cp,gas 469.91 J/mol×K 639.49 Joback Calculated Property
Cp,gas 486.10 J/mol×K 674.48 Joback Calculated Property
Cp,gas 501.52 J/mol×K 709.46 Joback Calculated Property
Cp,gas 516.24 J/mol×K 744.45 Joback Calculated Property
Cp,gas 530.36 J/mol×K 779.44 Joback Calculated Property

Similar Compounds

«beta»-Isocyclolavandulyl propionate. (-)-15-Acetoxygymnomitr-3-ene. «beta»-Isocyclolavandulyl isobutyrate. «beta»-Isocyclolavandulyl isovalerate. Myrtenyl acetate. myrtenyl 3-methylbutanoate. p-Mentha-1,8-dien-7-yl acetate. (-)-Myrtenol, trifluoroacetate. 2-pinen-10-yl isobutyrate. 14-Hydroxy-«beta»-caryophyllene acetate. 14-Acetoxy-«beta»-caryophyllene. Glutaric acid, di(myrtenyl) ester. Myrtenyl hexanoate. Myrtenyl laureate. Myrtenyl caprate.

Find more compounds similar to «beta»-Isocyclolavandulyl acetate.

Sources

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