Chemical Properties of trans-Chrysanthenyl acetate (CAS 54324-99-1)

trans-Chrysanthenyl acetate

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InChI
InChI=1S/C12H18O2/c1-7-5-6-9-11(14-8(2)13)10(7)12(9,3)4/h5,9-11H,6H2,1-4H3
InChI Key
UASZOTVHPVEMQR-UHFFFAOYSA-N
Formula
C12H18O2
SMILES
CC(=O)OC1C2CC=C(C)C1C2(C)C
Molecular Weight1
194.27
CAS
54324-99-1
Other Names
  • (E)-Chrysanthenyl acetate
  • trans -Crysanthenyl acetate
Sources

Physical Properties

Property Value Unit Source
Δf -74.94 kJ/mol Joback Calculated Property
Δfgas -375.50 kJ/mol Joback Calculated Property
Δfus 20.47 kJ/mol Joback Calculated Property
Δvap 50.64 kJ/mol Joback Calculated Property
logPoct/wat 2.54 Crippen Calculated Property
Pc 2405.28 kPa Joback Calculated Property
Tboil 563.04 K Joback Calculated Property
Tc 773.40 K Joback Calculated Property
Tfus 358.22 K Joback Calculated Property
Vc 0.62 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 419.92 J/mol×K 563.04 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 1
=C< (ring) 1
>C< (ring) 1
-CH3 4
>CH- (ring) 3
-CH2- (ring) 1

Similar Compounds

cis-Chrysanthenyl acetate. cis-Chrysanthenyl acetate. Chrysanthenyl acetate. Bicyclo[3.1.1]hept-2-en-6-ol, 2,7,7-trimethyl-, acetate, [1S-(1«alpha»,5«alpha»,6«beta»)]-. Chrysanthenyl propanoate. cis-Chrysanthenyl propionate. cis-Chrysanthenyl isobutyrate. cis-Chrysanthenyl butanoate. trans-Chrysanthenyl isovalerate. chrysanthenyl isovalerate I. chrysanthenyl isovalerate II. cis-Chrysanthenyl isovalerate. Chrysanthenyl isovalerate. cis-Chrysanthenyl pentanoate. Chrysanthenyl hexanoate.

Find more compounds similar to trans-Chrysanthenyl acetate.

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