Chemical Properties of 2-(Phenylthio)ethanol (CAS 699-12-7)

2-(Phenylthio)ethanol

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InChI
InChI=1S/C8H10OS/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChI Key
KWWZHCSQVRVQGF-UHFFFAOYSA-N
Formula
C8H10OS
SMILES
OCCSc1ccccc1
Molecular Weight1
154.23
CAS
699-12-7
Other Names
  • 2-Hydroxyethyl phenyl sulfide
  • Ethanol, 2-(phenylthio)-
  • Phenylthioethanol
Sources

Physical Properties

Property Value Unit Source
Δf 25.19 kJ/mol Joback Calculated Property
Δfgas -82.28 kJ/mol Joback Calculated Property
Δfus 18.74 kJ/mol Joback Calculated Property
Δvap 59.17 kJ/mol Joback Calculated Property
logPoct/wat 1.77 Crippen Calculated Property
Pc 4183.90 kPa Joback Calculated Property
Tboil 570.08 K Joback Calculated Property
Tc 786.58 K Joback Calculated Property
Tfus 301.56 K Joback Calculated Property
Vc 0.45 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 269.57 J/mol×K 570.08 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 1
-S- 1
-CH2- 2
-OH (alcohol) 1
=CH- (ring) 5

Similar Compounds

Benzene, (ethylthio)-. Acetic acid, (phenylthio)-. Sulfide, isopropyl phenyl. Benzene, (propylthio)-. Phenyl propargyl sulfide. Allylphenyl sulfide. Benzene, [(2-methylpropyl)thio]-. 1,2-Bis(phenylthio)ethane. Benzene, [(1,1-dimethylethyl)thio]-. Benzene, (methylthio)-. (Phenylthio)acetic acid methyl ester. Butylthiobenzene. trans-1-(Phenylthio)-2-butene. Benzene, (2-butenylthio)-, (Z)-. Ethanethioic acid, s-phenyl ester.

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