Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, di(4-bromophenyl) ester

InChI

InChI=1S/C20H18Br2O4/c21-13-5-9-15(10-6-13)25-19(23)17-3-1-2-4-18(17)20(24)26-16-11-7-14(22)8-12-16/h5-12,17-18H,1-4H2

InChI Key

XXZPHKWQZIFJGC-UHFFFAOYSA-N

Formula

C20H18Br2O4

SMILES

O=C(Oc1ccc(Br)cc1)C1CCCCC1C(=O)Oc1ccc(Br)cc1

Molecular Weight¹

482.16

• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	-99.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-408.97	kJ/mol	Joback Calculated Property
ΔfusH°	43.91	kJ/mol	Joback Calculated Property
ΔvapH°	97.29	kJ/mol	Joback Calculated Property
log10WS	-7.16		Crippen Calculated Property
logPoct/wat	5.529		Crippen Calculated Property
McVol	284.160	ml/mol	McGowan Calculated Property
Pc	2258.96	kPa	Joback Calculated Property
Inp	[3272.00; 3272.00]
Inp	3272.00		NIST
Inp	3272.00		NIST
Tboil	1020.10	K	Joback Calculated Property
Tc	1288.83	K	Joback Calculated Property
Tfus	660.10	K	Joback Calculated Property
Vc	1.044	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[838.04; 874.91]	J/mol×K	[1020.10; 1288.83]
Cp,gas	838.04	J/mol×K	1020.10	Joback Calculated Property
Cp,gas	848.16	J/mol×K	1064.89	Joback Calculated Property
Cp,gas	856.57	J/mol×K	1109.68	Joback Calculated Property
Cp,gas	863.38	J/mol×K	1154.46	Joback Calculated Property
Cp,gas	868.65	J/mol×K	1199.25	Joback Calculated Property
Cp,gas	872.46	J/mol×K	1244.04	Joback Calculated Property
Cp,gas	874.91	J/mol×K	1288.83	Joback Calculated Property
η	[0.0000475; 0.0002833]	Pa×s	[660.10; 1020.10]
η	0.0002833	Pa×s	660.10	Joback Calculated Property
η	0.0001859	Pa×s	720.10	Joback Calculated Property
η	0.0001301	Pa×s	780.10	Joback Calculated Property
η	0.0000958	Pa×s	840.10	Joback Calculated Property
η	0.0000735	Pa×s	900.10	Joback Calculated Property
η	0.0000583	Pa×s	960.10	Joback Calculated Property
η	0.0000475	Pa×s	1020.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, di(4-bromophenyl) ester.

Sources

• 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.