Chemical Properties of BENZYL METHYL DISULFIDE

InChI

InChI=1S/C8H10S2/c1-9-10-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3

InChI Key

NWYGPVZOBBHKLI-UHFFFAOYSA-N

Formula

C8H10S2

SMILES

CSSCc1ccccc1

Molecular Weight¹

170.30

Other Names

• Disulfide, methyl phenylmethyl
• Disulfide, benzyl methyl
• Methyl benzyl disulfide
• benzyl methyl disulphide

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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).
• I_np : Non-polar retention indices.
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[158.94; 366.71]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			9.11000e-01
Coefficient B			6.73700e-01
Coefficient C			-3.62200e-04
Coefficient D			5.43000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	158.94	J/mol×K	273.00	Calculated Property
Cp,gas	196.32	J/mol×K	353.78	Calculated Property
Cp,gas	229.73	J/mol×K	434.56	Calculated Property
Cp,gas	259.33	J/mol×K	515.33	Calculated Property
Cp,gas	285.31	J/mol×K	596.11	Calculated Property
Cp,gas	307.82	J/mol×K	676.89	Calculated Property
Cp,gas	327.04	J/mol×K	757.67	Calculated Property
Cp,gas	343.15	J/mol×K	838.44	Calculated Property
Cp,gas	356.32	J/mol×K	919.22	Calculated Property
Cp,gas	366.71	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to BENZYL METHYL DISULFIDE.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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