Chemical Properties of Farnesyl hexanoate, (E,E)-

Farnesyl hexanoate, (E,E)-

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InChI
InChI=1S/C21H36O2/c1-6-7-8-15-21(22)23-17-16-20(5)14-10-13-19(4)12-9-11-18(2)3/h11,13,16H,6-10,12,14-15,17H2,1-5H3/b19-13+,20-16+
InChI Key
RLRVQTPROCYANT-ZMLAXJCCSA-N
Formula
C21H36O2
SMILES
CCCCCC(=O)OCC=C(C)CCC=C(C)CCC=C(C)C
Molecular Weight1
320.51
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Physical Properties

Property Value Unit Source
Δf 107.03 kJ/mol Joback Calculated Property
Δfgas -399.28 kJ/mol Joback Calculated Property
Δfus 49.61 kJ/mol Joback Calculated Property
Δvap 71.61 kJ/mol Joback Calculated Property
log10WS -7.04 Crippen Calculated Property
logPoct/wat 6.529 Crippen Calculated Property
McVol 301.290 ml/mol McGowan Calculated Property
Pc 1098.62 kPa Joback Calculated Property
Inp [2181.00; 2181.00]   Show Hide
Inp 2181.00 NIST
Inp 2181.00 NIST
I 2472.00 NIST
Tboil 768.29 K Joback Calculated Property
Tc 955.62 K Joback Calculated Property
Tfus 341.47 K Joback Calculated Property
Vc 1.179 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [896.62; 997.58] J/mol×K [768.29; 955.62] Show Hide
Cp,gas 896.62 J/mol×K 768.29 Joback Calculated Property
Cp,gas 915.56 J/mol×K 799.51 Joback Calculated Property
Cp,gas 933.58 J/mol×K 830.73 Joback Calculated Property
Cp,gas 950.73 J/mol×K 861.96 Joback Calculated Property
Cp,gas 967.07 J/mol×K 893.18 Joback Calculated Property
Cp,gas 982.67 J/mol×K 924.40 Joback Calculated Property
Cp,gas 997.58 J/mol×K 955.62 Joback Calculated Property

Similar Compounds

(Z,Z)-Farnesyl caproate. (E,Z)-Farnesyl caproate. Neryl hexanoate. Hexanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-. (Z,E)-Farnesyl caproate. (Z,Z)-Farnesyl caprate. Neryl heptanoate. (Z,E)-Farnesyl caprate. Geranyl heptanoate. (E)-3,7-Dimethylocta-2,6-dien-1-yl icosanoate. (2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl dodecanoate. Farnesyl octanoate, (E,E)-. (E,E)-Farnesyl caprate. (2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl stearate. Geranyl octanoate.

Find more compounds similar to Farnesyl hexanoate, (E,E)-.

Sources

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