Chemical Properties of .beta.-Isocyclolavandulyl isovalerate

.beta.-Isocyclolavandulyl isovalerate

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InChI
InChI=1S/C15H26O2/c1-11(2)8-14(16)17-10-13-6-7-15(4,5)9-12(13)3/h6,11-12H,7-10H2,1-5H3/t12-/m0/s1
InChI Key
JRORWOFCFYWYNY-LBPRGKRZSA-N
Formula
C15H26O2
SMILES
CC(C)CC(=O)OCC1=CCC(C)(C)CC1C
Molecular Weight1
238.37
Sources

Physical Properties

Property Value Unit Source
Δf -129.36 kJ/mol Joback Calculated Property
Δfgas -507.48 kJ/mol Joback Calculated Property
Δfus 21.31 kJ/mol Joback Calculated Property
Δvap 57.67 kJ/mol Joback Calculated Property
logPoct/wat 3.96 Crippen Calculated Property
Pc 1786.37 kPa Joback Calculated Property
Tboil 637.71 K Joback Calculated Property
Tc 842.17 K Joback Calculated Property
Tfus 356.29 K Joback Calculated Property
Vc 0.81 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 591.64 J/mol×K 637.71 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 5
=CH- (ring) 1
=C< (ring) 1
-CH2- 2
>C< (ring) 1
>C=O (nonring) 1
>CH- (ring) 1
-CH2- (ring) 2

Similar Compounds

.beta.-Isocyclolavandulyl propionate. .beta.-Isocyclolavandulyl isobutyrate. .beta.-Isocyclolavandulyl acetate. .beta.-Cyclolavandulyl isovalerate. myrtenyl 3-methylbutanoate. .beta.-Cyclolavandulyl propionate. Myrtenyl 3-methylvalerate. «beta»-Cyclolavandulyl isobutyrate. (-)-15-Acetoxygymnomitr-3-ene. Myrtenyl hexanoate. .alpha.-Cyclogeraniol, acetate. Myrtenyl laureate. Myrtenyl caprate. Myrtenyl 2-methyl butyrate. 2-pinen-10-yl isobutyrate.

Find more compounds similar to .beta.-Isocyclolavandulyl isovalerate.

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