Chemical Properties of Dihydro-myrcenol acetate

Dihydro-myrcenol acetate

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InChI
InChI=1S/C12H22O2/c1-6-10(2)8-7-9-12(4,5)14-11(3)13/h2,6-9H2,1,3-5H3
InChI Key
VHVRYMDFTKNLFA-UHFFFAOYSA-N
Formula
C12H22O2
SMILES
C=C(CC)CCCC(C)(C)OC(C)=O
Molecular Weight1
198.30
Sources

Physical Properties

Property Value Unit Source
Δf -101.63 kJ/mol Joback Calculated Property
Δfgas -428.92 kJ/mol Joback Calculated Property
Δfus 19.62 kJ/mol Joback Calculated Property
Δvap 49.58 kJ/mol Joback Calculated Property
logPoct/wat 3.46 Crippen Calculated Property
Pc 1961.34 kPa Joback Calculated Property
Tboil 543.58 K Joback Calculated Property
Tc 728.61 K Joback Calculated Property
Tfus 283.86 K Joback Calculated Property
Vc 0.70 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 447.13 J/mol×K 543.58 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< 1
>C=O (nonring) 1
=CH2 1
-CH2- 4
>C< 1
-CH3 4

Similar Compounds

Myrcenyl acetate. Myrcenyl propionate. 6,10-Dihydromyrcenyl acetate. Isolinalyl acetate. «delta»-Terpineol, acetate. 3-Octanol, 3,7-dimethyl-, acetate. Cyclohexanol, 1-methyl-4-(1-methylethenyl)-, acetate. cis-terpenyl acetate. trans- «beta»-Terpinyl acetate. cis-«beta»-terpinyl acetate. Cyclohexanol, 1-methyl-, acetate. 12-Tridecen-2-yl acetate. 7-Methyl-2-octyl acetate. Acetic acid, 3-methylhept-3-yl ester. Isophytol, acetate.

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