Chemical Properties of Methyl 2-diethylaminoethyl sulfide

InChI

InChI=1S/C7H17NS/c1-4-8(5-2)6-7-9-3/h4-7H2,1-3H3

InChI Key

NCEBDVSAEIMPNE-UHFFFAOYSA-N

Formula

C7H17NS

SMILES

CCN(CC)CCSC

Molecular Weight¹

147.28

• 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

Property	Value	Unit	Source
ω	0.3625		Relay (1.0) Calculated Property
ΔfG°	151.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-93.94	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	21.04	kJ/mol	Joback Calculated Property
ΔvapH°	49.75	kJ/mol	Relay (1.0) Calculated Property
IE	8.14	eV	Relay (1.0) Calculated Property
log10WS	-0.36		Relay (1.0) Calculated Property
logPoct/wat	1.691		Crippen Calculated Property
McVol	135.820	ml/mol	McGowan Calculated Property
Pc	2844.44	kPa	Joback Calculated Property
Inp	[1076.00; 1076.00]
Inp	1076.00		NIST
Inp	1076.00		NIST
Tboil	453.26	K	Relay (1.0) Calculated Property
Tc	626.28	K	Relay (1.0) Calculated Property
Tfus	190.37	K	Relay (1.0) Calculated Property
Vc	0.469	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[275.98; 350.03]	J/mol×K	[440.78; 626.07]
Cp,gas	275.98	J/mol×K	440.78	Joback Calculated Property
Cp,gas	289.77	J/mol×K	471.66	Joback Calculated Property
Cp,gas	302.96	J/mol×K	502.54	Joback Calculated Property
Cp,gas	315.57	J/mol×K	533.42	Joback Calculated Property
Cp,gas	327.61	J/mol×K	564.31	Joback Calculated Property
Cp,gas	339.09	J/mol×K	595.19	Joback Calculated Property
Cp,gas	350.03	J/mol×K	626.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methyl 2-diethylaminoethyl sulfide.

Sources

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

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