Chemical Properties of Butanoic acid, 3-methyl-, 3,7-dimethyl-6-octenyl ester (CAS 68922-10-1)

Butanoic acid, 3-methyl-, 3,7-dimethyl-6-octenyl ester

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InChI
InChI=1S/C15H28O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,13-14H,6,8-11H2,1-5H3
InChI Key
WZTNQQJXPYEGAF-UHFFFAOYSA-N
Formula
C15H28O2
SMILES
CC(C)=CCCC(C)CCOC(=O)CC(C)C
Molecular Weight1
240.38
CAS
68922-10-1
Other Names
  • Citronellyl iso-valerate
  • 3,7-dimethyloct-6-enyl isovalerate
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Physical Properties

Property Value Unit Source
Δf -91.71 kJ/mol Joback Calculated Property
Δfgas -500.86 kJ/mol Joback Calculated Property
Δfus 29.24 kJ/mol Joback Calculated Property
Δvap 57.40 kJ/mol Joback Calculated Property
log10WS -4.33 Crippen Calculated Property
logPoct/wat 4.348 Crippen Calculated Property
McVol 225.350 ml/mol McGowan Calculated Property
Pc 1551.22 kPa Joback Calculated Property
Inp [1558.00; 1563.00]   Show Hide
Inp 1558.00 NIST
Inp 1558.00 NIST
Inp 1563.00 NIST
Inp 1563.00 NIST
Inp 1563.00 NIST
I 1800.00 NIST
Tboil 622.05 K Joback Calculated Property
Tc 803.00 K Joback Calculated Property
Tfus 281.93 K Joback Calculated Property
Vc 0.869 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [601.07; 696.20] J/mol×K [622.05; 803.00] Show Hide
Cp,gas 601.07 J/mol×K 622.05 Joback Calculated Property
Cp,gas 618.93 J/mol×K 652.21 Joback Calculated Property
Cp,gas 635.95 J/mol×K 682.37 Joback Calculated Property
Cp,gas 652.16 J/mol×K 712.52 Joback Calculated Property
Cp,gas 667.59 J/mol×K 742.68 Joback Calculated Property
Cp,gas 682.26 J/mol×K 772.84 Joback Calculated Property
Cp,gas 696.20 J/mol×K 803.00 Joback Calculated Property

Similar Compounds

3,7-dimethyl-6-octenyl 3,7-dimethyloct-6-enoate. Citronellyl butyrate. Citronellyl isoheptanoate. Citronellyl hexanoate. Citronellyl valerate. Adipic acid, di(«beta»-citronellyl) ester. 6-Octen-1-ol, 3,7-dimethyl-, propanoate. Citronellyl heptanoate. 3,7-Dimethyloct-6-en-1-yl decanoate. 3,7-Dimethyloct-6-en-1-yl tetradecanoate. Adipic acid, «beta»-citronellyl hexyl ester. 3,7-Dimethyloct-6-en-1-yl dodecanoate. Adipic acid, «beta»-citronellyl pentyl ester. Citronellyl octanoate. Adipic acid, «beta»-citronellyl butyl ester.

Find more compounds similar to Butanoic acid, 3-methyl-, 3,7-dimethyl-6-octenyl ester.

Sources

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