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

• ω : Acentric Factor.
• 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).
• 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).
• 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

• Cheméo Relay (1.0)
• 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.