Chemical Properties of Propanoic acid, 2-amino,3-[3,5-diiodo-4-[4-hydroxy-3-(1-methylethyl)phenoxy]phenyl]- (CAS 10439-94-8)

InChI

InChI=1S/C18H19I2NO4/c1-9(2)12-8-11(3-4-16(12)22)25-17-13(19)5-10(6-14(17)20)7-15(21)18(23)24/h3-6,8-9,15,22H,7,21H2,1-2H3,(H,23,24)

InChI Key

RNNRJYLAQGIPJH-UHFFFAOYSA-N

Formula

C18H19I2NO4

SMILES

CC(C)c1cc(Oc2c(I)cc(CC(N)C(=O)O)cc2I)ccc1O

Molecular Weight¹

567.16

CAS

10439-94-8

• ω : Acentric Factor.
• 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).
• 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	[856.68; 942.66]	J/mol×K	[1191.54; 1467.76]
Cp,gas	856.68	J/mol×K	1191.54	Joback Calculated Property
Cp,gas	869.52	J/mol×K	1237.58	Joback Calculated Property
Cp,gas	882.71	J/mol×K	1283.61	Joback Calculated Property
Cp,gas	896.42	J/mol×K	1329.65	Joback Calculated Property
Cp,gas	910.86	J/mol×K	1375.69	Joback Calculated Property
Cp,gas	926.21	J/mol×K	1421.72	Joback Calculated Property
Cp,gas	942.66	J/mol×K	1467.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propanoic acid, 2-amino,3-[3,5-diiodo-4-[4-hydroxy-3-(1-methylethyl)phenoxy]phenyl]-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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