Chemical Properties of Methyl 2-diisopropylaminoethyl sulfide

InChI

InChI=1S/C9H21NS/c1-8(2)10(9(3)4)6-7-11-5/h8-9H,6-7H2,1-5H3

InChI Key

LTZXYLOWXWDULT-UHFFFAOYSA-N

Formula

C9H21NS

SMILES

CSCCN(C(C)C)C(C)C

Molecular Weight¹

175.34

• 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	0.3746		Relay (1.0) Calculated Property
ΔfG°	163.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-125.92	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	19.17	kJ/mol	Joback Calculated Property
ΔvapH°	52.86	kJ/mol	Relay (1.0) Calculated Property
IE	7.65	eV	Relay (1.0) Calculated Property
log10WS	-0.67		Relay (1.0) Calculated Property
logPoct/wat	2.468		Crippen Calculated Property
McVol	164.000	ml/mol	McGowan Calculated Property
Pc	2377.22	kPa	Joback Calculated Property
Inp	[1196.00; 1196.00]
Inp	1196.00		NIST
Inp	1196.00		NIST
Tboil	477.05	K	Relay (1.0) Calculated Property
Tc	650.73	K	Relay (1.0) Calculated Property
Tfus	213.62	K	Relay (1.0) Calculated Property
Vc	0.556	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[364.11; 452.04]	J/mol×K	[485.66; 675.38]
Cp,gas	364.11	J/mol×K	485.66	Joback Calculated Property
Cp,gas	380.61	J/mol×K	517.28	Joback Calculated Property
Cp,gas	396.34	J/mol×K	548.90	Joback Calculated Property
Cp,gas	411.33	J/mol×K	580.52	Joback Calculated Property
Cp,gas	425.60	J/mol×K	612.14	Joback Calculated Property
Cp,gas	439.16	J/mol×K	643.76	Joback Calculated Property
Cp,gas	452.04	J/mol×K	675.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methyl 2-diisopropylaminoethyl sulfide.

Sources

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

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