Chemical Properties of 4-Hydroxy-2-isopropenyl-5-methylhex-5-enyl acetate, epimer

4-Hydroxy-2-isopropenyl-5-methylhex-5-enyl acetate, epimer

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InChI
InChI=1S/C12H20O3/c1-8(2)11(7-15-10(5)13)6-12(14)9(3)4/h11-12,14H,1,3,6-7H2,2,4-5H3
InChI Key
WZDDZSJLPOFSIZ-UHFFFAOYSA-N
Formula
C12H20O3
SMILES
C=C(C)C(O)CC(COC(C)=O)C(=C)C
Molecular Weight1
212.29

Physical Properties

Property Value Unit Source
Δf -166.88 kJ/mol Joback Calculated Property
Δfgas -467.32 kJ/mol Joback Calculated Property
Δfus 21.48 kJ/mol Joback Calculated Property
Δvap 66.19 kJ/mol Joback Calculated Property
log10WS -2.55 Crippen Calculated Property
logPoct/wat 2.069 Crippen Calculated Property
McVol 184.650 ml/mol McGowan Calculated Property
Pc 2220.80 kPa Joback Calculated Property
Inp [1407.00; 1407.00]   Show Hide
Inp 1407.00 NIST
Inp 1407.00 NIST
I [2172.00; 2172.00]   Show Hide
I 2172.00 NIST
I 2172.00 NIST
Tboil 634.67 K Joback Calculated Property
Tc 814.83 K Joback Calculated Property
Tfus 296.54 K Joback Calculated Property
Vc 0.703 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [486.19; 556.49] J/mol×K [634.67; 814.83] Show Hide
Cp,gas 486.19 J/mol×K 634.67 Joback Calculated Property
Cp,gas 499.46 J/mol×K 664.70 Joback Calculated Property
Cp,gas 512.08 J/mol×K 694.72 Joback Calculated Property
Cp,gas 524.07 J/mol×K 724.75 Joback Calculated Property
Cp,gas 535.46 J/mol×K 754.78 Joback Calculated Property
Cp,gas 546.26 J/mol×K 784.80 Joback Calculated Property
Cp,gas 556.49 J/mol×K 814.83 Joback Calculated Property

Similar Compounds

4-Hydroxy-2-isopropenyl-5-methylhex-5-enyl acetate. 4-Hydroxy-2-isopropenyl-5-methylhex-5-enyl isobutyrate. 4-Hydroxy-2-isopropenyl-5-methylhex-5-enyl 2-methylbutyrate. trans-5-Isopropenyl-2,2-dimethyltetrahydro-furan-3-yl-methyl acetate. cis-5-Isopropenyl-2,2-dimethyltetrahydro-furan-3-yl-methyl acetate. Sobrerol 8-acetate. Khusinol acetate. Aristolactone. 5,11-Epoxycadin-1(10)-en-9-ol. Pentadeca-2,5E,13-triene, 7-acetoxymethyl-2,6,10,14-tetramethyl-10-17-epoxy (Peucelinenoxide acetate). Reynosin. 2-Norbornanol, 5-methyl-6-methylene, acetate. neo-isopulegol acetate. Isopulegol acetate. Neo-iso-Isopulegol acetate.

Find more compounds similar to 4-Hydroxy-2-isopropenyl-5-methylhex-5-enyl acetate, epimer.

Sources

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