- InChI
- InChI=1S/C16H14I2N2O3/c17-11-6-9(7-12(18)14(11)21)8-13(15(19)22)20-16(23)10-4-2-1-3-5-10/h1-7,13,21H,8H2,(H2,19,22)(H,20,23)
- InChI Key
- QJPXSFLBPXVGFN-UHFFFAOYSA-N
- Formula
- C16H14I2N2O3
- SMILES
-
NC(=O)C(Cc1cc(I)c(O)c(I)c1)NC(
=O)c1ccccc1 - Molecular Weight1
- 536.10
- CAS
- 195067-02-8
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 146.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -90.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.03 | kJ/mol | Joback Calculated Property |
| log10WS | -5.43 | Crippen Calculated Property | |
| logPoct/wat | 2.428 | Crippen Calculated Property | |
| McVol | 269.390 | ml/mol | McGowan Calculated Property |
| Pc | 3042.32 | kPa | Joback Calculated Property |
| Tboil | 1125.70 | K | Joback Calculated Property |
| Tc | 1417.69 | K | Joback Calculated Property |
| Tfus | 796.58 | K | Joback Calculated Property |
| Vc | 0.927 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [725.38; 817.16] | J/mol×K | [1125.70; 1417.69] | 
|
| Cp,gas | 725.38 | J/mol×K | 1125.70 | Joback Calculated Property |
| Cp,gas | 738.06 | J/mol×K | 1174.37 | Joback Calculated Property |
| Cp,gas | 751.42 | J/mol×K | 1223.03 | Joback Calculated Property |
| Cp,gas | 765.73 | J/mol×K | 1271.70 | Joback Calculated Property |
| Cp,gas | 781.28 | J/mol×K | 1320.36 | Joback Calculated Property |
| Cp,gas | 798.33 | J/mol×K | 1369.03 | Joback Calculated Property |
| Cp,gas | 817.16 | J/mol×K | 1417.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Alpha-benzamido-4-hydroxy-3,5-diiodohydrocinnamamide.
Sources
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