Chemical Properties of 3-(butanoylthio)hexyl butanoate

3-(butanoylthio)hexyl butanoate

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InChI
InChI=1S/C14H26O3S/c1-4-7-12(18-14(16)9-6-3)10-11-17-13(15)8-5-2/h12H,4-11H2,1-3H3
InChI Key
IAAVYXKIYUAQRX-UHFFFAOYSA-N
Formula
C14H26O3S
SMILES
CCCC(=O)OCCC(CCC)SC(=O)CCC
Molecular Weight1
274.42
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Physical Properties

Property Value Unit Source
Δf -265.16 kJ/mol Joback Calculated Property
Δfgas -653.08 kJ/mol Joback Calculated Property
Δfus 37.01 kJ/mol Joback Calculated Property
Δvap 69.09 kJ/mol Joback Calculated Property
log10WS -4.32 Crippen Calculated Property
logPoct/wat 3.948 Crippen Calculated Property
McVol 233.480 ml/mol McGowan Calculated Property
Pc 1696.30 kPa Joback Calculated Property
I [2214.00; 2214.00]   Show Hide
I 2214.00 NIST
I 2214.00 NIST
Tboil 718.22 K Joback Calculated Property
Tc 910.73 K Joback Calculated Property
Tfus 389.03 K Joback Calculated Property
Vc 0.897 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [656.11; 737.72] J/mol×K [718.22; 910.73] Show Hide
Cp,gas 656.11 J/mol×K 718.22 Joback Calculated Property
Cp,gas 671.89 J/mol×K 750.31 Joback Calculated Property
Cp,gas 686.78 J/mol×K 782.39 Joback Calculated Property
Cp,gas 700.80 J/mol×K 814.48 Joback Calculated Property
Cp,gas 713.96 J/mol×K 846.56 Joback Calculated Property
Cp,gas 726.26 J/mol×K 878.65 Joback Calculated Property
Cp,gas 737.72 J/mol×K 910.73 Joback Calculated Property

Similar Compounds

3-(hexanoylthio) hexyl hexanoate. 3-(acetylthio)hexyl acetate. 3-(Methylthio)hexyl butanoate. 3-(Methylthio)hexyl hexanoate. hexyl 3-(methylthio)propanoate. 3-(Methylthio)hexyl acetate. trans-2-methyl-4- n-propyl-1,3-oxathiane. cis-2-methyl-4- n-propyl-1,3-oxathiane. (6S,9R)-Vomifolyl 9-O-«beta»-D-glucopyranoside, TFA. Vomifolyl «beta»-D-glucopyranoside, TFA. Vomifoliol, «beta»-D-glucopyranoside, TFA. Vomifoliol, rutinoside, TFA. trans-13-Cinnamoyloxylupanine. cis-13-Cinnamoyloxylupanine. T-2 Mycotoxin.

Find more compounds similar to 3-(butanoylthio)hexyl butanoate.

Sources

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