Chemical Properties of (E)-Ocimenyl acetate

(E)-Ocimenyl acetate

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InChI
InChI=1S/C12H18O2/c1-6-10(4)8-12(7-9(2)3)14-11(5)13/h6-8,12H,1H2,2-5H3/b10-8+
InChI Key
ZOOSZTPUIIHGKF-CSKARUKUSA-N
Formula
C12H18O2
SMILES
C=CC(C)=CC(C=C(C)C)OC(C)=O
Molecular Weight1
194.27
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Physical Properties

Property Value Unit Source
Δf 44.98 kJ/mol Joback Calculated Property
Δfgas -200.80 kJ/mol Joback Calculated Property
Δfus 22.60 kJ/mol Joback Calculated Property
Δvap 50.48 kJ/mol Joback Calculated Property
log10WS -3.38 Crippen Calculated Property
logPoct/wat 3.017 Crippen Calculated Property
McVol 174.480 ml/mol McGowan Calculated Property
Pc 2143.35 kPa Joback Calculated Property
I 1661.00 NIST
Tboil 554.57 K Joback Calculated Property
Tc 751.89 K Joback Calculated Property
Tfus 242.32 K Joback Calculated Property
Vc 0.668 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [407.13; 486.68] J/mol×K [554.57; 751.89] Show Hide
Cp,gas 407.13 J/mol×K 554.57 Joback Calculated Property
Cp,gas 422.29 J/mol×K 587.46 Joback Calculated Property
Cp,gas 436.63 J/mol×K 620.34 Joback Calculated Property
Cp,gas 450.20 J/mol×K 653.23 Joback Calculated Property
Cp,gas 463.04 J/mol×K 686.12 Joback Calculated Property
Cp,gas 475.19 J/mol×K 719.01 Joback Calculated Property
Cp,gas 486.68 J/mol×K 751.89 Joback Calculated Property

Similar Compounds

trans-Ocimenol. iso-Ocimenol. (Z)-«beta»-Ocimenol. ipsdienyl acetate. «beta»-Ionyl acetate. Retinol, acetate. 3-Methyl-2-butenoic acid, oct-3-en-2-yl ester. Retinyl butanoate. Dehydrocostunolide. Artemisia acetate. Artemisyl acetate. 6-Acetoxycaryophyllene. Retinyl octanoate. Retinol, hexadecanoate, 11-cis-. Retinyl decanoate.

Find more compounds similar to (E)-Ocimenyl acetate.

Sources

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