Chemical Properties of Ether, chloromethyl dichloromethyl (CAS 2799-32-8)

InChI

InChI=1S/C2H3Cl3O/c3-1-6-2(4)5/h2H,1H2

InChI Key

MCXRKNYHEMVMIT-UHFFFAOYSA-N

Formula

C2H3Cl3O

SMILES

ClCOC(Cl)Cl

Molecular Weight¹

149.40

CAS

2799-32-8

• 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°	11.19	kJ/mol	Joback Calculated Property
logPoct/wat	1.960		Crippen Calculated Property
McVol	81.630	ml/mol	McGowan Calculated Property
Inp	[852.00; 852.00]
Inp	852.00		NIST
Inp	852.00		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	[103.21; 166.36]	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			6.35610e+01
Coefficient B			1.56900e-01
Coefficient C			-3.84000e-05
Coefficient D			-1.57000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	103.21	J/mol×K	273.00	Calculated Property
Cp,gas	113.57	J/mol×K	353.78	Calculated Property
Cp,gas	123.20	J/mol×K	434.56	Calculated Property
Cp,gas	132.07	J/mol×K	515.33	Calculated Property
Cp,gas	140.12	J/mol×K	596.11	Calculated Property
Cp,gas	147.30	J/mol×K	676.89	Calculated Property
Cp,gas	153.57	J/mol×K	757.67	Calculated Property
Cp,gas	158.86	J/mol×K	838.44	Calculated Property
Cp,gas	163.15	J/mol×K	919.22	Calculated Property
Cp,gas	166.36	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0043724; 0.0002936]	Pa×s	[209.29; 404.06]	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			-1.10353e+01
Coefficient B			1.17263e+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.			209.29
Temperature range, max.			404.06
η	0.0043724	Pa×s	209.29	Calculated Property
η	0.0025864	Pa×s	230.93	Calculated Property
η	0.0016739	Pa×s	252.57	Calculated Property
η	0.0011604	Pa×s	274.21	Calculated Property
η	0.0008487	Pa×s	295.85	Calculated Property
η	0.0006478	Pa×s	317.49	Calculated Property
η	0.0005118	Pa×s	339.13	Calculated Property
η	0.0004159	Pa×s	360.77	Calculated Property
η	0.0003460	Pa×s	382.41	Calculated Property
η	0.0002936	Pa×s	404.06	Calculated Property

Similar Compounds

Find more compounds similar to Ether, chloromethyl dichloromethyl.

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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