Chemical Properties of Bis(2-chloroisopropyl) ether (CAS 39638-32-9)

InChI

InChI=1S/C6H12Cl2O/c1-5(2,7)9-6(3,4)8/h1-4H3

InChI Key

BULHJTXRZFEUDQ-UHFFFAOYSA-N

Formula

C6H12Cl2O

SMILES

CC(C)(Cl)OC(C)(C)Cl

Molecular Weight¹

171.06

CAS

39638-32-9

Other Names

• 2,2'-oxybis[2-chloropropane]
• Propane, 2,2'-oxybis*2-chloro-
• propane, 2,2'-oxybis[2-chloro-

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• n₀ : Refractive Index.
• 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	0.3589		Relay (1.0) Calculated Property
ΔfG°	-123.54	kJ/mol	Joback Calculated Property
ΔfH°gas	-411.43	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	6.05	kJ/mol	Joback Calculated Property
ΔvapH°	45.88	kJ/mol	Relay (1.0) Calculated Property
IE	9.91	eV	Relay (1.0) Calculated Property
log10WS	-2.60		Relay (1.0) Calculated Property
logPoct/wat	2.953		Crippen Calculated Property
McVol	125.750	ml/mol	McGowan Calculated Property
Pc	2931.34	kPa	Joback Calculated Property
Inp	[1023.00; 1055.00]
Inp	1023.00		NIST
Inp	1055.00		NIST
Inp	1029.00		NIST
Inp	1029.00		NIST
Tboil	412.47	K	Relay (1.0) Calculated Property
Tc	608.93	K	Relay (1.0) Calculated Property
Tfus	240.78	K	Relay (1.0) Calculated Property
Vc	0.483	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[172.06; 366.85]	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			-2.30000e-01
Coefficient B			7.75880e-01
Coefficient C			-5.76000e-04
Coefficient D			1.67200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	172.06	J/mol×K	273.00	Calculated Property
Cp,gas	209.57	J/mol×K	353.78	Calculated Property
Cp,gas	241.88	J/mol×K	434.56	Calculated Property
Cp,gas	269.52	J/mol×K	515.33	Calculated Property
Cp,gas	293.02	J/mol×K	596.11	Calculated Property
Cp,gas	312.90	J/mol×K	676.89	Calculated Property
Cp,gas	329.69	J/mol×K	757.67	Calculated Property
Cp,gas	343.93	J/mol×K	838.44	Calculated Property
Cp,gas	356.14	J/mol×K	919.22	Calculated Property
Cp,gas	366.85	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0075907; 0.0002686]	Pa×s	[244.29; 442.72]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.23359e+01
Coefficient B			1.82121e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			244.29
Temperature range, max.			442.72
η	0.0075907	Pa×s	244.29	Calculated Property
η	0.0040951	Pa×s	266.34	Calculated Property
η	0.0024279	Pa×s	288.38	Calculated Property
η	0.0015504	Pa×s	310.43	Calculated Property
η	0.0010507	Pa×s	332.48	Calculated Property
η	0.0007474	Pa×s	354.53	Calculated Property
η	0.0005533	Pa×s	376.57	Calculated Property
η	0.0004234	Pa×s	398.62	Calculated Property
η	0.0003332	Pa×s	420.67	Calculated Property
η	0.0002686	Pa×s	442.72	Calculated Property

Similar Compounds

Find more compounds similar to Bis(2-chloroisopropyl) ether.

Mixtures

• Propane, 1,2-dichloro- + Bis(2-chloroisopropyl) ether

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Vapor-Liquid Equilibria of Selected Components in Propylene Oxide Production
• Joback Method
• McGowan Method
• NIST Webbook

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