Chemical Properties of 2-Mercaptohexyl-4-acetate

2-Mercaptohexyl-4-acetate

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InChI
InChI=1S/C8H16O2S/c1-4-8(5-6(2)11)10-7(3)9/h6,8,11H,4-5H2,1-3H3
InChI Key
JVSSZFATQMMTDW-UHFFFAOYSA-N
Formula
C8H16O2S
SMILES
CCC(CC(C)S)OC(C)=O
Molecular Weight1
176.28
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Physical Properties

Property Value Unit Source
Δf -192.93 kJ/mol Joback Calculated Property
Δfgas -425.33 kJ/mol Joback Calculated Property
Δfus 16.26 kJ/mol Joback Calculated Property
Δvap 48.52 kJ/mol Joback Calculated Property
log10WS -2.33 Crippen Calculated Property
logPoct/wat 2.036 Crippen Calculated Property
McVol 147.370 ml/mol McGowan Calculated Property
Pc 2890.51 kPa Joback Calculated Property
Inp [1149.00; 1157.00]   Show Hide
Inp 1157.00 NIST
Inp 1149.00 NIST
Inp 1157.00 NIST
Inp 1149.00 NIST
Inp 1157.00 NIST
I [1578.00; 1596.00]   Show Hide
I 1578.00 NIST
I 1596.00 NIST
I 1578.00 NIST
Tboil 520.71 K Joback Calculated Property
Tc 723.56 K Joback Calculated Property
Tfus 258.54 K Joback Calculated Property
Vc 0.549 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [329.93; 401.82] J/mol×K [520.71; 723.56] Show Hide
Cp,gas 329.93 J/mol×K 520.71 Joback Calculated Property
Cp,gas 343.43 J/mol×K 554.52 Joback Calculated Property
Cp,gas 356.32 J/mol×K 588.33 Joback Calculated Property
Cp,gas 368.60 J/mol×K 622.14 Joback Calculated Property
Cp,gas 380.27 J/mol×K 655.94 Joback Calculated Property
Cp,gas 391.34 J/mol×K 689.75 Joback Calculated Property
Cp,gas 401.82 J/mol×K 723.56 Joback Calculated Property

Similar Compounds

2-Mercaptohexyl-4-acetate, # 1. 2-Mercaptohexyl-4-acetate, # 2. 4-Mercaptononyl-2-acetate, # 2. 4-Mercaptononyl-2-acetate. 4-Mercaptononyl-2-acetate, # 1. 4-mercaptopentyl-2-acetate. 4-Mercaptopentyl-2-acetate, # 2. 4-Mercaptopentyl-2-acetate, # 1. 5-Methyl-4-mercaptohexyl-2-acetate, # 1. 5-Methyl-4-mercaptohexyl-2-acetate, # 2. 5-Methyl-4-mercaptohexyl-2-acetate. 4-Mercapto-3-methylpentyl-2-acetate, # 1. 4-Mercapto-3-methylpentyl-2-acetate, # 2. 4-Mercapto-3-methylpentyl-2-acetate. 1-Mercaptopentyl-3-acetate.

Find more compounds similar to 2-Mercaptohexyl-4-acetate.

Sources

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