Chemical Properties of 2-Diethylaminoethyl isobutyl sulfide

InChI

InChI=1S/C10H23NS/c1-5-11(6-2)7-8-12-9-10(3)4/h10H,5-9H2,1-4H3

InChI Key

ZBDCZOMEKJDMLI-UHFFFAOYSA-N

Formula

C10H23NS

SMILES

CCN(CC)CCSCC(C)C

Molecular Weight¹

189.36

Other Names

• Isobutyl 2-diethylaminoethyl sulfide

• 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	0.4436		Relay (1.0) Calculated Property
ΔfG°	174.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-176.50	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	25.28	kJ/mol	Joback Calculated Property
ΔvapH°	58.60	kJ/mol	Relay (1.0) Calculated Property
IE	8.28	eV	Relay (1.0) Calculated Property
log10WS	-2.12		Relay (1.0) Calculated Property
logPoct/wat	2.717		Crippen Calculated Property
McVol	178.090	ml/mol	McGowan Calculated Property
Pc	2153.30	kPa	Joback Calculated Property
Inp	[1292.00; 1297.00]
Inp	1292.00		NIST
Inp	1292.00		NIST
Inp	1292.00		NIST
Inp	1297.00		NIST
Tboil	488.71	K	Relay (1.0) Calculated Property
Tc	664.39	K	Relay (1.0) Calculated Property
Tfus	188.02	K	Relay (1.0) Calculated Property
Vc	0.635	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[410.83; 500.84]	J/mol×K	[508.98; 692.70]
Cp,gas	410.83	J/mol×K	508.98	Joback Calculated Property
Cp,gas	427.67	J/mol×K	539.60	Joback Calculated Property
Cp,gas	443.75	J/mol×K	570.22	Joback Calculated Property
Cp,gas	459.08	J/mol×K	600.84	Joback Calculated Property
Cp,gas	473.70	J/mol×K	631.46	Joback Calculated Property
Cp,gas	487.61	J/mol×K	662.08	Joback Calculated Property
Cp,gas	500.84	J/mol×K	692.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Diethylaminoethyl isobutyl sulfide.

Sources

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

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