Chemical Properties of Tetrahydrofuran, 3-chloro-2-[2-chloro-1-(chloromethyl)ethyloxy]

InChI

InChI=1S/C7H11Cl3O2/c8-3-5(4-9)12-7-6(10)1-2-11-7/h5-7H,1-4H2

InChI Key

QFPRNAFYPZCLKW-UHFFFAOYSA-N

Formula

C7H11Cl3O2

SMILES

ClCC(CCl)OC1OCCC1Cl

Molecular Weight¹

233.52

Other Names

• 2-(2-Chloro-1-chloromethyl-ethoxy)- 3-chloro-tetrahydro-furan

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	27.13	kJ/mol	Joback Calculated Property
logPoct/wat	2.203		Crippen Calculated Property
McVol	147.090	ml/mol	McGowan Calculated Property
Inp	[1435.00; 1435.00]
Inp	1435.00		NIST
Inp	1435.00		NIST
Inp	1435.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[195.68; 433.79]	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			2.17920e+01
Coefficient B			7.34100e-01
Coefficient C			-3.68500e-04
Coefficient D			4.64000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	195.68	J/mol×K	273.00	Calculated Property
Cp,gas	237.43	J/mol×K	353.78	Calculated Property
Cp,gas	275.02	J/mol×K	434.56	Calculated Property
Cp,gas	308.59	J/mol×K	515.33	Calculated Property
Cp,gas	338.28	J/mol×K	596.11	Calculated Property
Cp,gas	364.25	J/mol×K	676.89	Calculated Property
Cp,gas	386.64	J/mol×K	757.67	Calculated Property
Cp,gas	405.59	J/mol×K	838.44	Calculated Property
Cp,gas	421.26	J/mol×K	919.22	Calculated Property
Cp,gas	433.79	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0033336; 0.0003685]	Pa×s	[298.87; 523.62]	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			-1.08347e+01
Coefficient B			1.53351e+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.			298.87
Temperature range, max.			523.62
η	0.0033336	Pa×s	298.87	Calculated Property
η	0.0022443	Pa×s	323.84	Calculated Property
η	0.0015990	Pa×s	348.81	Calculated Property
η	0.0011921	Pa×s	373.79	Calculated Property
η	0.0009220	Pa×s	398.76	Calculated Property
η	0.0007350	Pa×s	423.73	Calculated Property
η	0.0006009	Pa×s	448.70	Calculated Property
η	0.0005018	Pa×s	473.67	Calculated Property
η	0.0004267	Pa×s	498.64	Calculated Property
η	0.0003685	Pa×s	523.62	Calculated Property

Similar Compounds

Find more compounds similar to Tetrahydrofuran, 3-chloro-2-[2-chloro-1-(chloromethyl)ethyloxy].

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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