Chemical Properties of Dihydrocarvyl acetate (CAS 20777-49-5)

Dihydrocarvyl acetate

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InChI
InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3
InChI Key
TUSIZTVSUSBSQI-UHFFFAOYSA-N
Formula
C12H20O2
SMILES
C=C(C)C1CCC(C)C(OC(C)=O)C1
Molecular Weight1
196.29
CAS
20777-49-5
Other Names
  • (1«alpha»,2«beta»,5«alpha»)-2-methyl-5-(1-methylvinyl)cyclohexyl acetate
  • 2-Methyl-5-(1-methylethenyl)-cyclohexyl acetate
  • 2-Methyl-5-(1-methylethenyl)cyclohexyl acetate, (1«alpha»,2«beta»,5«alpha»)-
  • 5-Isopropenyl-2-methylcyclohexyl acetate, (1«alpha»,2«beta»,5«alpha»)-
  • 8-p-Menthen-2-yl acetate
  • Carhydrine
  • Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,2R,5R)-rel-
  • Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5R)-rel-
  • Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1«alpha»,2«beta»,5«alpha»)-
  • Dihydrocarveol acetate
  • Dihydrocarveol acetate (Isomer 2)
  • Dihydrocarveyl acetate
  • Tuberyl acetate
  • p-Menth-8-en-2-ol, acetate
  • p-Menth-8-en-2-yl acetate
  • p-Mentha-8-en-2-ol, acetate
Sources

Physical Properties

Property Value Unit Source
Δf -95.44 kJ/mol Joback Calculated Property
Δfgas -406.53 kJ/mol Joback Calculated Property
Δfus 21.01 kJ/mol Joback Calculated Property
Δvap 50.68 kJ/mol Joback Calculated Property
logPoct/wat 2.93 Crippen Calculated Property
Pc 2187.68 kPa Joback Calculated Property
Tboil 506.20 K NIST
Tc 763.76 K Joback Calculated Property
Tfus 280.34 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 435.53 J/mol×K 557.02 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 3
=CH2 1
=C< 1
>C=O (nonring) 1
>CH- (ring) 3
-CH2- (ring) 3

Similar Compounds

(-)-8-p-Menthen-2-yl, acetate, trans. Isodihydrocarveol, acetate. neo-Isodihydrocarveol, acetate. neo-dihydro carveol acetate. iso-Dihydrocarveol acetate. Neoiso-dihydrocarveol acetate. Neo-iso-Isopulegol acetate. Isopulegol acetate. neo-isopulegol acetate. p-Menth-8-en-3-ol, acetate. isopulegol acetate. Neoisocarvomenthyl acetate. Neocarvomenthyl acetate. Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1«alpha»,2«beta»,5«alpha»)-. Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate, (1«alpha»,2«beta»,5«beta»)-.

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