Chemical Properties of (4R,5S)-(+)-4-Methyl-5-phenyl-1,3-oxazolidine-2-thione (CAS 91794-28-4)

InChI

InChI=1S/C10H11NOS/c1-7-9(12-10(13)11-7)8-5-3-2-4-6-8/h2-7,9H,1H3,(H,11,13)

InChI Key

KQSZLXCAZDPTNY-UHFFFAOYSA-N

Formula

C10H11NOS

SMILES

CC1N=C(S)OC1c1ccccc1

Molecular Weight¹

193.26

CAS

91794-28-4

• 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	[366.62; 450.99]	J/mol×K	[613.14; 885.79]
Cp,gas	366.62	J/mol×K	613.14	Joback Calculated Property
Cp,gas	384.27	J/mol×K	658.58	Joback Calculated Property
Cp,gas	400.44	J/mol×K	704.02	Joback Calculated Property
Cp,gas	415.17	J/mol×K	749.46	Joback Calculated Property
Cp,gas	428.48	J/mol×K	794.91	Joback Calculated Property
Cp,gas	440.40	J/mol×K	840.35	Joback Calculated Property
Cp,gas	450.99	J/mol×K	885.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to (4R,5S)-(+)-4-Methyl-5-phenyl-1,3-oxazolidine-2-thione.

Sources

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

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