Chemical Properties of 4-Mercapto-3-methylpentyl-2-acetate

4-Mercapto-3-methylpentyl-2-acetate

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InChI
InChI=1S/C8H16O2S/c1-5(7(3)11)6(2)10-8(4)9/h5-7,11H,1-4H3
InChI Key
HQPZOLJRLYJHKW-UHFFFAOYSA-N
Formula
C8H16O2S
SMILES
CC(=O)OC(C)C(C)C(C)S
Molecular Weight1
176.28
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Physical Properties

Property Value Unit Source
Δf -195.37 kJ/mol Joback Calculated Property
Δfgas -430.61 kJ/mol Joback Calculated Property
Δfus 12.74 kJ/mol Joback Calculated Property
Δvap 48.13 kJ/mol Joback Calculated Property
log10WS -2.09 Crippen Calculated Property
logPoct/wat 1.892 Crippen Calculated Property
McVol 147.370 ml/mol McGowan Calculated Property
Pc 2915.53 kPa Joback Calculated Property
Inp [1166.00; 1170.00]   Show Hide
Inp 1170.00 NIST
Inp 1166.00 NIST
Inp 1170.00 NIST
I [1613.00; 1623.00]   Show Hide
I 1613.00 NIST
I 1623.00 NIST
Tboil 520.27 K Joback Calculated Property
Tc 727.60 K Joback Calculated Property
Tfus 243.54 K Joback Calculated Property
Vc 0.543 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [330.21; 403.78] J/mol×K [520.27; 727.60] Show Hide
Cp,gas 330.21 J/mol×K 520.27 Joback Calculated Property
Cp,gas 344.08 J/mol×K 554.83 Joback Calculated Property
Cp,gas 357.30 J/mol×K 589.38 Joback Calculated Property
Cp,gas 369.88 J/mol×K 623.94 Joback Calculated Property
Cp,gas 381.81 J/mol×K 658.49 Joback Calculated Property
Cp,gas 393.11 J/mol×K 693.05 Joback Calculated Property
Cp,gas 403.78 J/mol×K 727.60 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to 4-Mercapto-3-methylpentyl-2-acetate.

Sources

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