Chemical Properties of 1,2-Dichloropropyl propyl ether

InChI

InChI=1S/C6H12Cl2O/c1-3-4-9-6(8)5(2)7/h5-6H,3-4H2,1-2H3

InChI Key

BGZOWNBTBBZBLL-UHFFFAOYSA-N

Formula

C6H12Cl2O

SMILES

CCCOC(Cl)C(C)Cl

Molecular Weight¹

171.07

• 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).
• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	13.83	kJ/mol	Joback Calculated Property
ΔvapH°	49.41	kJ/mol	Relay (1.0) Calculated Property
log10WS	-2.13		Relay (1.0) Calculated Property
logPoct/wat	2.605		Crippen Calculated Property
McVol	125.750	ml/mol	McGowan Calculated Property
Inp	[1013.00; 1013.00]
Inp	1013.00		NIST
Inp	1013.00		NIST
Tboil	434.11	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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	[174.35; 364.99]	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			4.53520e+01
Coefficient B			5.36040e-01
Coefficient C			-2.38800e-04
Coefficient D			2.24000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	174.35	J/mol×K	273.00	Calculated Property
Cp,gas	206.09	J/mol×K	353.78	Calculated Property
Cp,gas	235.03	J/mol×K	434.56	Calculated Property
Cp,gas	261.24	J/mol×K	515.33	Calculated Property
Cp,gas	284.78	J/mol×K	596.11	Calculated Property
Cp,gas	305.73	J/mol×K	676.89	Calculated Property
Cp,gas	324.15	J/mol×K	757.67	Calculated Property
Cp,gas	340.12	J/mol×K	838.44	Calculated Property
Cp,gas	353.71	J/mol×K	919.22	Calculated Property
Cp,gas	364.99	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0084256; 0.0002531]	Pa×s	[209.45; 435.05]	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			-1.15359e+01
Coefficient B			1.41577e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			209.45
Temperature range, max.			435.05
η	0.0084256	Pa×s	209.45	Calculated Property
η	0.0040910	Pa×s	234.52	Calculated Property
η	0.0022838	Pa×s	259.58	Calculated Property
η	0.0014128	Pa×s	284.65	Calculated Property
η	0.0009446	Pa×s	309.71	Calculated Property
η	0.0006708	Pa×s	334.78	Calculated Property
η	0.0004997	Pa×s	359.85	Calculated Property
η	0.0003867	Pa×s	384.91	Calculated Property
η	0.0003088	Pa×s	409.98	Calculated Property
η	0.0002531	Pa×s	435.05	Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Dichloropropyl propyl ether.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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