Chemical Properties of Tris-(2-chloroethyl)orthoformate (CAS 18719-58-9)

InChI

InChI=1S/C7H13Cl3O3/c8-1-4-11-7(12-5-2-9)13-6-3-10/h7H,1-6H2

InChI Key

RKHRVKJTCSHZCR-UHFFFAOYSA-N

Formula

C7H13Cl3O3

SMILES

ClCCOC(OCCCl)OCCCl

Molecular Weight¹

251.53

CAS

18719-58-9

Other Names

• Tris(chloroethyl)orthoformate
• Ethane, 1,1',1''-[methylidynetris(oxy)]tris[2-chloro-
• Orthoformic acid, tris(2-chloroethyl) ester
• 2-Chloroethyl orthoformate

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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 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	[240.09; 461.32]	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			1.10016e+02
Coefficient B			5.05500e-01
Coefficient C			-8.84000e-05
Coefficient D			-6.58000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	240.09	J/mol×K	273.00	Calculated Property
Cp,gas	274.87	J/mol×K	353.78	Calculated Property
Cp,gas	307.59	J/mol×K	434.56	Calculated Property
Cp,gas	338.04	J/mol×K	515.33	Calculated Property
Cp,gas	366.00	J/mol×K	596.11	Calculated Property
Cp,gas	391.27	J/mol×K	676.89	Calculated Property
Cp,gas	413.65	J/mol×K	757.67	Calculated Property
Cp,gas	432.92	J/mol×K	838.44	Calculated Property
Cp,gas	448.88	J/mol×K	919.22	Calculated Property
Cp,gas	461.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0020410; 0.0001914]	Pa×s	[310.10; 507.36]	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			-1.22814e+01
Coefficient B			1.88761e+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.			310.10
Temperature range, max.			507.36
η	0.0020410	Pa×s	310.10	Calculated Property
η	0.0013656	Pa×s	332.02	Calculated Property
η	0.0009604	Pa×s	353.94	Calculated Property
η	0.0007037	Pa×s	375.85	Calculated Property
η	0.0005336	Pa×s	397.77	Calculated Property
η	0.0004164	Pa×s	419.69	Calculated Property
η	0.0003331	Pa×s	441.61	Calculated Property
η	0.0002722	Pa×s	463.52	Calculated Property
η	0.0002265	Pa×s	485.44	Calculated Property
η	0.0001914	Pa×s	507.36	Calculated Property

Similar Compounds

Find more compounds similar to Tris-(2-chloroethyl)orthoformate.

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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