Chemical Properties of 1,1,2,2,3-pentachloropropane (CAS 16714-68-4)

InChI

InChI=1S/C3H3Cl5/c4-1-3(7,8)2(5)6/h2H,1H2

InChI Key

IYFMQUDCYNWFTL-UHFFFAOYSA-N

Formula

C3H3Cl5

SMILES

ClCC(Cl)(Cl)C(Cl)Cl

Molecular Weight¹

216.32

CAS

16714-68-4

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• P_vap : Vapor pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[171.79; 199.11]	J/mol×K	[451.72; 677.99]
Cp,gas	171.79	J/mol×K	451.72	Joback Calculated Property
Cp,gas	177.68	J/mol×K	489.43	Joback Calculated Property
Cp,gas	182.98	J/mol×K	527.14	Joback Calculated Property
Cp,gas	187.72	J/mol×K	564.86	Joback Calculated Property
Cp,gas	191.97	J/mol×K	602.57	Joback Calculated Property
Cp,gas	195.75	J/mol×K	640.28	Joback Calculated Property
Cp,gas	199.11	J/mol×K	677.99	Joback Calculated Property
η	[0.0004201; 0.0069460]	Pa×s	[260.59; 451.72]
η	0.0069460	Pa×s	260.59	Joback Calculated Property
η	0.0033734	Pa×s	292.45	Joback Calculated Property
η	0.0018881	Pa×s	324.30	Joback Calculated Property
η	0.0011723	Pa×s	356.16	Joback Calculated Property
η	0.0007872	Pa×s	388.01	Joback Calculated Property
η	0.0005615	Pa×s	419.87	Joback Calculated Property
η	0.0004201	Pa×s	451.72	Joback Calculated Property
ΔvapH	46.30	kJ/mol	406.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 207.25]	kPa	[340.52; 495.60]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.41284e+01
Coefficient B			-3.74071e+03
Coefficient C			-7.02530e+01
Temperature range, min.			340.52
Temperature range, max.			495.60
Pvap	1.33	kPa	340.52	Calculated Property
Pvap	3.06	kPa	357.75	Calculated Property
Pvap	6.38	kPa	374.98	Calculated Property
Pvap	12.30	kPa	392.21	Calculated Property
Pvap	22.20	kPa	409.44	Calculated Property
Pvap	37.84	kPa	426.68	Calculated Property
Pvap	61.39	kPa	443.91	Calculated Property
Pvap	95.44	kPa	461.14	Calculated Property
Pvap	142.96	kPa	478.37	Calculated Property
Pvap	207.25	kPa	495.60	Calculated Property

Similar Compounds

Find more compounds similar to 1,1,2,2,3-pentachloropropane.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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