Chemical Properties of 1-Sec-butoxy-2,4,5-trichlorobenzene (CAS 116435-15-5)

InChI

InChI=1S/C10H11Cl3O/c1-3-6(2)14-10-5-8(12)7(11)4-9(10)13/h4-6H,3H2,1-2H3

InChI Key

LUERAVPFGMTONP-UHFFFAOYSA-N

Formula

C10H11Cl3O

SMILES

CCC(C)Oc1cc(Cl)c(Cl)cc1Cl

Molecular Weight¹

253.55

CAS

116435-15-5

• 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[359.56; 420.64]	J/mol×K	[604.09; 829.18]
Cp,gas	359.56	J/mol×K	604.09	Joback Calculated Property
Cp,gas	371.44	J/mol×K	641.61	Joback Calculated Property
Cp,gas	382.62	J/mol×K	679.12	Joback Calculated Property
Cp,gas	393.12	J/mol×K	716.64	Joback Calculated Property
Cp,gas	402.95	J/mol×K	754.15	Joback Calculated Property
Cp,gas	412.12	J/mol×K	791.67	Joback Calculated Property
Cp,gas	420.64	J/mol×K	829.18	Joback Calculated Property
η	[0.0001647; 0.0011917]	Pa×s	[363.43; 604.09]
η	0.0011917	Pa×s	363.43	Joback Calculated Property
η	0.0007273	Pa×s	403.54	Joback Calculated Property
η	0.0004853	Pa×s	443.65	Joback Calculated Property
η	0.0003463	Pa×s	483.76	Joback Calculated Property
η	0.0002603	Pa×s	523.87	Joback Calculated Property
η	0.0002037	Pa×s	563.98	Joback Calculated Property
η	0.0001647	Pa×s	604.09	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Sec-butoxy-2,4,5-trichlorobenzene.

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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