Chemical Properties of P-mentha-1,8-dien-7-yl acetate (CAS 15111-96-3)

P-mentha-1,8-dien-7-yl acetate

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InChI
InChI=1S/C12H18O2/c1-9(2)12-6-4-11(5-7-12)8-14-10(3)13/h4,12H,1,5-8H2,2-3H3
InChI Key
WTXBCFKGCNWPLS-UHFFFAOYSA-N
Formula
C12H18O2
SMILES
C=C(C)C1CC=C(COC(C)=O)CC1
Molecular Weight1
194.27
CAS
15111-96-3
Other Names
  • (4-Isopropenyl-1-cyclohexen-1-yl)methyl acetate
  • 1-Cyclohexene-1-methanol, 4-(1-methylethenyl)-, acetate
  • 4-(1-Methylvinyl)cyclohex-1-ene-1-methyl acetate
  • Cyclohex-1-ene-1-methanol-4-(1-methylethenyl)-acetate
  • Dihydrocuminyl acetate
  • Perilla acetate
  • Perilla alcohol, acetate
  • Perillyl acetate
  • p-Mentha-1,8-dien-7-ol, acetate
Sources

Physical Properties

Property Value Unit Source
Δf -59.69 kJ/mol Joback Calculated Property
Δfgas -319.54 kJ/mol Joback Calculated Property
Δfus 19.70 kJ/mol Joback Calculated Property
Δvap 52.25 kJ/mol Joback Calculated Property
logPoct/wat 2.852 Crippen Calculated Property
Pc 2377.22 kPa Joback Calculated Property
Tboil 570.50 K Joback Calculated Property
Tc 780.42 K Joback Calculated Property
Tfus 302.10 K Joback Calculated Property
Vc 0.632 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 414.43 J/mol×K 570.5 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< 1
=CH- (ring) 1
=CH2 1
=C< (ring) 1
-CH2- 1
-CH3 2
>C=O (nonring) 1
>CH- (ring) 1
-CH2- (ring) 3

Similar Compounds

Perillyl isobutyrate. Lanceol acetate. limonen-10-yl acetate. p-mentha-1,8-dien-9-yl propanoate. .beta.-Isocyclolavandulyl acetate. 1,8(10)-p-Menthadien-9-yl 3-methylbutanoate. .beta.-Isocyclolavandulyl propionate. 1,8(10)-p-Menthadien-9-yl 2-methylbutanoate. .beta.-Isocyclolavandulyl isobutyrate. «beta»-Cyclolavandulyl acetate. .beta.-Isocyclolavandulyl isovalerate. 14-Acetoxy-«beta»-caryophyllene. 14-Hydroxy-«beta»-caryophyllene acetate. .beta.-Cyclolavandulyl propionate. Citryl acetate.

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