Chemical Properties of Hydrocinnamic acid, 4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo- (CAS 51-26-3)

InChI

InChI=1S/C15H11I3O4/c16-10-7-9(2-3-13(10)19)22-15-11(17)5-8(6-12(15)18)1-4-14(20)21/h2-3,5-7,19H,1,4H2,(H,20,21)

InChI Key

VRORTNGXAKZJML-UHFFFAOYSA-N

Formula

C15H11I3O4

SMILES

O=C(O)CCc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1

Molecular Weight¹

635.96

CAS

51-26-3

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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	[656.92; 753.87]	J/mol×K	[1144.05; 1447.91]
Cp,gas	656.92	J/mol×K	1144.05	Joback Calculated Property
Cp,gas	669.79	J/mol×K	1194.69	Joback Calculated Property
Cp,gas	683.62	J/mol×K	1245.34	Joback Calculated Property
Cp,gas	698.67	J/mol×K	1295.98	Joback Calculated Property
Cp,gas	715.22	J/mol×K	1346.62	Joback Calculated Property
Cp,gas	733.53	J/mol×K	1397.27	Joback Calculated Property
Cp,gas	753.87	J/mol×K	1447.91	Joback Calculated Property
η	[0.0000009; 0.0000066]	Pa×s	[830.46; 1144.05]
η	0.0000066	Pa×s	830.46	Joback Calculated Property
η	0.0000043	Pa×s	882.72	Joback Calculated Property
η	0.0000029	Pa×s	934.99	Joback Calculated Property
η	0.0000021	Pa×s	987.25	Joback Calculated Property
η	0.0000015	Pa×s	1039.52	Joback Calculated Property
η	0.0000012	Pa×s	1091.78	Joback Calculated Property
η	0.0000009	Pa×s	1144.05	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hydrocinnamic acid, 4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo-.

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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