Chemical Properties of Citronellyl hexanoate (CAS 10580-25-3)

Citronellyl hexanoate

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InChI
InChI=1S/C16H30O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,15H,5-8,10-13H2,1-4H3
InChI Key
KNYRCCKTQMBSFP-UHFFFAOYSA-N
Formula
C16H30O2
SMILES
CCCCCC(=O)OCCC(C)CCC=C(C)C
Molecular Weight1
254.41
CAS
10580-25-3
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Physical Properties

Property Value Unit Source
Δf -80.85 kJ/mol Joback Calculated Property
Δfgas -516.22 kJ/mol Joback Calculated Property
Δfus 35.35 kJ/mol Joback Calculated Property
Δvap 60.02 kJ/mol Joback Calculated Property
log10WS -4.99 Crippen Calculated Property
logPoct/wat 4.883 Crippen Calculated Property
McVol 239.440 ml/mol McGowan Calculated Property
Pc 1431.55 kPa Joback Calculated Property
Inp [1700.00; 1722.10]   Show Hide
Inp 1720.00 NIST
Inp 1722.10 NIST
Inp 1700.00 NIST
Tboil 645.37 K Joback Calculated Property
Tc 822.41 K Joback Calculated Property
Tfus 308.20 K Joback Calculated Property
Vc 0.930 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [655.22; 751.09] J/mol×K [645.37; 822.41] Show Hide
Cp,gas 655.22 J/mol×K 645.37 Joback Calculated Property
Cp,gas 673.18 J/mol×K 674.88 Joback Calculated Property
Cp,gas 690.31 J/mol×K 704.38 Joback Calculated Property
Cp,gas 706.65 J/mol×K 733.89 Joback Calculated Property
Cp,gas 722.20 J/mol×K 763.40 Joback Calculated Property
Cp,gas 737.01 J/mol×K 792.90 Joback Calculated Property
Cp,gas 751.09 J/mol×K 822.41 Joback Calculated Property

Similar Compounds

Citronellyl valerate. Adipic acid, di(«beta»-citronellyl) ester. Citronellyl isoheptanoate. Citronellyl heptanoate. 3,7-Dimethyloct-6-en-1-yl decanoate. 3,7-Dimethyloct-6-en-1-yl dodecanoate. Adipic acid, «beta»-citronellyl pentyl ester. Citronellyl octanoate. Adipic acid, «beta»-citronellyl hexyl ester. 3,7-dimethyloct-6-en-1-yl stearate. 3,7-Dimethyloct-6-en-1-yl nonanoate. 3,7-Dimethyloct-6-en-1-yl tetradecanoate. Adipic acid, «beta»-citronellyl butyl ester. 3,7-Dimethyloct-6-en-1-yl palmitate. Citronellyl icosanoate.

Find more compounds similar to Citronellyl hexanoate.

Sources

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