Chemical Properties of 5-(2'-Hydroxybenzylidene)-2-thiohydantoin (CAS 636-86-2)

InChI

InChI=1S/C10H8N2O2S/c13-8-4-2-1-3-6(8)5-7-9(14)12-10(15)11-7/h1-5,13H,(H2,11,12,14,15)/b7-5+

InChI Key

DAJICUYKPNPGQQ-FNORWQNLSA-N

Formula

C10H8N2O2S

SMILES

O=C1NC(=S)NC1=Cc1ccccc1O

Molecular Weight¹

220.25

CAS

636-86-2

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[392.96; 452.44]	J/mol×K	[799.65; 1090.76]
Cp,gas	392.96	J/mol×K	799.65	Joback Calculated Property
Cp,gas	404.06	J/mol×K	848.17	Joback Calculated Property
Cp,gas	414.48	J/mol×K	896.69	Joback Calculated Property
Cp,gas	424.39	J/mol×K	945.21	Joback Calculated Property
Cp,gas	433.92	J/mol×K	993.72	Joback Calculated Property
Cp,gas	443.22	J/mol×K	1042.24	Joback Calculated Property
Cp,gas	452.44	J/mol×K	1090.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5-(2'-Hydroxybenzylidene)-2-thiohydantoin.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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