- InChI
- InChI=1S/C6H3I3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
- InChI Key
- VAPDZNUFNKUROY-UHFFFAOYSA-N
- Formula
- C6H3I3O
- SMILES
- Oc1c(I)cc(I)cc1I
- Molecular Weight1
- 471.80
- CAS
- 609-23-4
- Other Names
-
- 2,4,6-Triiodophenol
- 2,4,6-Trijodfenol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Inp : Non-polar retention indices.
- 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° | 112.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 99.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.68 | kJ/mol | Joback Calculated Property |
| log10WS | -4.46 | Crippen Calculated Property | |
| logPoct/wat | 3.206 | Crippen Calculated Property | |
| McVol | 154.970 | ml/mol | McGowan Calculated Property |
| Pc | 5029.93 | kPa | Joback Calculated Property |
| Inp | [1962.00; 1962.00] |
|
|
| Inp | 1962.00 | NIST | |
| Inp | 1962.00 | NIST | |
| Inp | 1962.00 | NIST | |
| Tboil | 733.36 | K | Joback Calculated Property |
| Tc | 1072.25 | K | Joback Calculated Property |
| Tfus | 494.74 | K | Joback Calculated Property |
| Vc | 0.493 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [230.38; 263.34] | J/mol×K | [733.36; 1072.25] |
|
| Cp,gas | 230.38 | J/mol×K | 733.36 | Joback Calculated Property |
| Cp,gas | 235.09 | J/mol×K | 789.84 | Joback Calculated Property |
| Cp,gas | 239.70 | J/mol×K | 846.32 | Joback Calculated Property |
| Cp,gas | 244.51 | J/mol×K | 902.80 | Joback Calculated Property |
| Cp,gas | 249.85 | J/mol×K | 959.29 | Joback Calculated Property |
| Cp,gas | 256.02 | J/mol×K | 1015.77 | Joback Calculated Property |
| Cp,gas | 263.34 | J/mol×K | 1072.25 | Joback Calculated Property |
| η | [0.0000202; 0.0003621] | Pa×s | [494.74; 733.36] |
|
| η | 0.0003621 | Pa×s | 494.74 | Joback Calculated Property |
| η | 0.0001873 | Pa×s | 534.51 | Joback Calculated Property |
| η | 0.0001061 | Pa×s | 574.28 | Joback Calculated Property |
| η | 0.0000647 | Pa×s | 614.05 | Joback Calculated Property |
| η | 0.0000419 | Pa×s | 653.82 | Joback Calculated Property |
| η | 0.0000285 | Pa×s | 693.59 | Joback Calculated Property |
| η | 0.0000202 | Pa×s | 733.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 2,4,6-triiodo-.
Sources
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