Chemical Properties of Tetrabromophenolphthalein, ethyl ester (CAS 1176-74-5)

InChI

InChI=1S/C22H14Br4O4/c1-2-30-22(29)14-6-4-3-5-13(14)19(11-7-15(23)20(27)16(24)8-11)12-9-17(25)21(28)18(26)10-12/h3-10,27H,2H2,1H3

InChI Key

SQFXATUXPUCFFO-UHFFFAOYSA-N

Formula

C22H14Br4O4

SMILES

CCOC(=O)c1ccccc1C(=C1C=C(Br)C(=O)C(Br)=C1)c1cc(Br)c(O)c(Br)c1

Molecular Weight¹

661.96

CAS

1176-74-5

Other Names

• ethyl 2-[(3,5-dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzoate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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	[930.25; 1030.31]	J/mol×K	[1299.45; 1604.46]
Cp,gas	930.25	J/mol×K	1299.45	Joback Calculated Property
Cp,gas	944.28	J/mol×K	1350.28	Joback Calculated Property
Cp,gas	959.03	J/mol×K	1401.12	Joback Calculated Property
Cp,gas	974.75	J/mol×K	1451.95	Joback Calculated Property
Cp,gas	991.71	J/mol×K	1502.79	Joback Calculated Property
Cp,gas	1010.15	J/mol×K	1553.62	Joback Calculated Property
Cp,gas	1030.31	J/mol×K	1604.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tetrabromophenolphthalein, ethyl 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.