Chemical Properties of Benzoic acid, 2-(trifluoroacetylthio)-, methyl ester

Benzoic acid, 2-(trifluoroacetylthio)-, methyl ester

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InChI
InChI=1S/C10H7F3O3S/c1-16-8(14)6-4-2-3-5-7(6)17-9(15)10(11,12)13/h2-5H,1H3
InChI Key
KZDAPZDUVLDWOO-UHFFFAOYSA-N
Formula
C10H7F3O3S
SMILES
COC(=O)c1ccccc1SC(=O)C(F)(F)F
Molecular Weight1
264.22
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Physical Properties

Property Value Unit Source
Δf -775.21 kJ/mol Joback Calculated Property
Δfgas -937.26 kJ/mol Joback Calculated Property
Δfus 25.65 kJ/mol Joback Calculated Property
Δvap 59.76 kJ/mol Joback Calculated Property
log10WS -3.31 Crippen Calculated Property
logPoct/wat 2.654 Crippen Calculated Property
McVol 158.670 ml/mol McGowan Calculated Property
Pc 2915.53 kPa Joback Calculated Property
Inp [1390.00; 1390.00]   Show Hide
Inp 1390.00 NIST
Inp 1390.00 NIST
Tboil 653.38 K Joback Calculated Property
Tc 873.50 K Joback Calculated Property
Tfus 402.08 K Joback Calculated Property
Vc 0.615 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [390.71; 441.97] J/mol×K [653.38; 873.50] Show Hide
Cp,gas 390.71 J/mol×K 653.38 Joback Calculated Property
Cp,gas 401.29 J/mol×K 690.07 Joback Calculated Property
Cp,gas 411.02 J/mol×K 726.75 Joback Calculated Property
Cp,gas 419.92 J/mol×K 763.44 Joback Calculated Property
Cp,gas 428.03 J/mol×K 800.12 Joback Calculated Property
Cp,gas 435.37 J/mol×K 836.81 Joback Calculated Property
Cp,gas 441.97 J/mol×K 873.50 Joback Calculated Property

Similar Compounds

Benzoic acid, 2-(acetylthio)-, methyl ester. Benzoic acid, 2-(pentafluoropropionylthio)-, methyl ester. Benzoic acid, 2-(heptafluorobutyrylthio)-, methyl ester. Acetic 2-(acetylsulfanyl)benzoic anhydride. Benzoic acid, 2-trifluoroacetylthio-, trimethylsilyl ester. Benzoic acid, 2-(ethylthio)-, methyl ester. Benzoic acid, 2-isopropylthio-, methyl ester. Benzoic acid, 2-(methylthio)-, methyl ester. Benzoic acid, 2-(pentafluoropropionylthio)-. Benzoic acid, 2-(ethylthio)-, ethyl ester. Benzoic acid, 2-pentafluoropropionylthio-, trimethylsilyl ester. Benzoic acid, 2-(methylthio)-, ethyl ester. Benzoic acid, 2-(propylthio)-, methyl ester. Benzoic acid, 2-(2-methylpropyl)thio-, methyl ester. Benzoic acid, 2-acetylthio-, trimethylsilyl ester.

Find more compounds similar to Benzoic acid, 2-(trifluoroacetylthio)-, methyl ester.

Sources

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