Chemical Properties of Heptyl 2,4,5-trichlorophenyl ether (CAS 116401-40-2)

InChI

InChI=1S/C13H17Cl3O/c1-2-3-4-5-6-7-17-13-9-11(15)10(14)8-12(13)16/h8-9H,2-7H2,1H3

InChI Key

PUMPSSGWHRRHJN-UHFFFAOYSA-N

Formula

C13H17Cl3O

SMILES

CCCCCCCOc1cc(Cl)c(Cl)cc1Cl

Molecular Weight¹

295.63

CAS

116401-40-2

• 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).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[506.25; 577.26]	J/mol×K	[673.17; 882.88]
Cp,gas	506.25	J/mol×K	673.17	Joback Calculated Property
Cp,gas	520.00	J/mol×K	708.12	Joback Calculated Property
Cp,gas	532.96	J/mol×K	743.07	Joback Calculated Property
Cp,gas	545.15	J/mol×K	778.02	Joback Calculated Property
Cp,gas	556.58	J/mol×K	812.98	Joback Calculated Property
Cp,gas	567.28	J/mol×K	847.93	Joback Calculated Property
Cp,gas	577.26	J/mol×K	882.88	Joback Calculated Property
η	[0.0001279; 0.0008792]	Pa×s	[412.24; 673.17]
η	0.0008792	Pa×s	412.24	Joback Calculated Property
η	0.0005470	Pa×s	455.73	Joback Calculated Property
η	0.0003696	Pa×s	499.22	Joback Calculated Property
η	0.0002660	Pa×s	542.71	Joback Calculated Property
η	0.0002010	Pa×s	586.19	Joback Calculated Property
η	0.0001578	Pa×s	629.68	Joback Calculated Property
η	0.0001279	Pa×s	673.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to Heptyl 2,4,5-trichlorophenyl ether.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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