Chemical Properties of 1-Sulfanyl-3-butyl acetate

1-Sulfanyl-3-butyl acetate

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InChI
InChI=1S/C6H12O2S/c1-5(3-4-9)8-6(2)7/h5,9H,3-4H2,1-2H3
InChI Key
PPGZGGPLMMKFKW-UHFFFAOYSA-N
Formula
C6H12O2S
SMILES
CC(=O)OC(C)CCS
Molecular Weight1
148.22
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Physical Properties

Property Value Unit Source
Δf -207.33 kJ/mol Joback Calculated Property
Δfgas -378.77 kJ/mol Joback Calculated Property
Δfus 14.60 kJ/mol Joback Calculated Property
Δvap 44.45 kJ/mol Joback Calculated Property
log10WS -1.38 Crippen Calculated Property
logPoct/wat 1.258 Crippen Calculated Property
McVol 119.190 ml/mol McGowan Calculated Property
Pc 3560.02 kPa Joback Calculated Property
Inp [1024.00; 1024.00]   Show Hide
Inp 1024.00 NIST
Inp 1024.00 NIST
I [1542.00; 1542.00]   Show Hide
I 1542.00 NIST
I 1542.00 NIST
Tboil 475.39 K Joback Calculated Property
Tc 679.41 K Joback Calculated Property
Tfus 251.00 K Joback Calculated Property
Vc 0.444 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [244.02; 302.80] J/mol×K [475.39; 679.41] Show Hide
Cp,gas 244.02 J/mol×K 475.39 Joback Calculated Property
Cp,gas 254.95 J/mol×K 509.39 Joback Calculated Property
Cp,gas 265.43 J/mol×K 543.40 Joback Calculated Property
Cp,gas 275.45 J/mol×K 577.40 Joback Calculated Property
Cp,gas 285.02 J/mol×K 611.41 Joback Calculated Property
Cp,gas 294.14 J/mol×K 645.41 Joback Calculated Property
Cp,gas 302.80 J/mol×K 679.41 Joback Calculated Property

Similar Compounds

1-Mercaptobutyl-3-acetate. 1-Mercaptopentyl-3-acetate. 4-mercaptopentyl-2-acetate. 4-Mercaptopentyl-2-acetate, # 2. 4-Mercaptopentyl-2-acetate, # 1. sec-Butyl acetate. 2-Mercaptohexyl-4-acetate. 2-Mercaptohexyl-4-acetate, # 2. 2-Mercaptohexyl-4-acetate, # 1. sec-butyl 3-(methylthio)propanoate. Acetic acid, chloro-, 1-methylpropyl ester. Propanoic acid, 1-methylpropyl ester. 4-Mercaptononyl-2-acetate. 4-Mercaptononyl-2-acetate, # 2. 4-Mercaptononyl-2-acetate, # 1.

Find more compounds similar to 1-Sulfanyl-3-butyl acetate.

Sources

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