Chemical Properties of Bis(2-diisopropylaminoethyl) sulfide (CAS 110501-56-9)

InChI

InChI=1S/C16H36N2S/c1-13(2)17(14(3)4)9-11-19-12-10-18(15(5)6)16(7)8/h13-16H,9-12H2,1-8H3

InChI Key

VRSFIFVYZVUBLG-UHFFFAOYSA-N

Formula

C16H36N2S

SMILES

CC(C)N(CCSCCN(C(C)C)C(C)C)C(C)C

Molecular Weight¹

288.54

CAS

110501-56-9

Other Names

• Sulfane, bis(2-diisopropylaminoethyl)-

• 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).
• 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
ΔfG°	328.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-217.76	kJ/mol	Joback Calculated Property
ΔfusH°	33.28	kJ/mol	Joback Calculated Property
ΔvapH°	60.56	kJ/mol	Joback Calculated Property
log10WS	-3.99		Crippen Calculated Property
logPoct/wat	3.957		Crippen Calculated Property
McVol	272.610	ml/mol	McGowan Calculated Property
Pc	1362.64	kPa	Joback Calculated Property
Inp	[1820.00; 1836.10]
Inp	1820.00		NIST
Inp	1836.10		NIST
Inp	1820.00		NIST
Inp	1836.10		NIST
Inp	1820.00		NIST
Tboil	657.38	K	Joback Calculated Property
Tc	839.15	K	Joback Calculated Property
Tfus	309.42	K	Joback Calculated Property
Vc	0.998	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[768.79; 878.86]	J/mol×K	[657.38; 839.15]
Cp,gas	768.79	J/mol×K	657.38	Joback Calculated Property
Cp,gas	789.68	J/mol×K	687.67	Joback Calculated Property
Cp,gas	809.50	J/mol×K	717.97	Joback Calculated Property
Cp,gas	828.29	J/mol×K	748.26	Joback Calculated Property
Cp,gas	846.09	J/mol×K	778.56	Joback Calculated Property
Cp,gas	862.94	J/mol×K	808.85	Joback Calculated Property
Cp,gas	878.86	J/mol×K	839.15	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bis(2-diisopropylaminoethyl) sulfide.

Sources

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

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