- InChI
- InChI=1S/C6H5IO/c7-5-1-3-6(8)4-2-5/h1-4,8H
- InChI Key
- VSMDINRNYYEDRN-UHFFFAOYSA-N
- Formula
- C6H5IO
- SMILES
- Oc1ccc(I)cc1
- Molecular Weight1
- 220.01
- CAS
- 540-38-5
- Other Names
-
- 4-iodophenol
- Phenol, p-iodo-
- p-iodophenol
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- IE : Ionization energy (eV).
- 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).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔcH°solid | -2980.30 ± 4.20 | kJ/mol | NIST |
| ΔfG° | 15.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -31.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.61 | kJ/mol | Joback Calculated Property |
| IE | 8.06 | eV | NIST |
| log10WS | -2.17 | Crippen Calculated Property | |
| logPoct/wat | 1.997 | Crippen Calculated Property | |
| McVol | 103.330 | ml/mol | McGowan Calculated Property |
| Pc | 5602.57 | kPa | Joback Calculated Property |
| Inp | [1359.00; 1434.00] |
|
|
| Inp | 1398.00 | NIST | |
| Inp | 1434.00 | NIST | |
| Inp | 1359.00 | NIST | |
| Inp | 1398.00 | NIST | |
| Inp | 1359.00 | NIST | |
| Inp | 1398.00 | NIST | |
| Tboil | 537.12 | K | Joback Calculated Property |
| Tc | 808.34 | K | Joback Calculated Property |
| Tfus | 365.80 | K | Crystal... |
| Vc | 0.318 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [182.45; 220.68] | J/mol×K | [537.12; 808.34] |
|
| Cp,gas | 182.45 | J/mol×K | 537.12 | Joback Calculated Property |
| Cp,gas | 190.59 | J/mol×K | 582.32 | Joback Calculated Property |
| Cp,gas | 197.83 | J/mol×K | 627.53 | Joback Calculated Property |
| Cp,gas | 204.31 | J/mol×K | 672.73 | Joback Calculated Property |
| Cp,gas | 210.19 | J/mol×K | 717.93 | Joback Calculated Property |
| Cp,gas | 215.59 | J/mol×K | 763.14 | Joback Calculated Property |
| Cp,gas | 220.68 | J/mol×K | 808.34 | Joback Calculated Property |
| η | [0.0000916; 0.0035242] | Pa×s | [353.58; 537.12] |
|
| η | 0.0035242 | Pa×s | 353.58 | Joback Calculated Property |
| η | 0.0015054 | Pa×s | 384.17 | Joback Calculated Property |
| η | 0.0007290 | Pa×s | 414.76 | Joback Calculated Property |
| η | 0.0003900 | Pa×s | 445.35 | Joback Calculated Property |
| η | 0.0002261 | Pa×s | 475.94 | Joback Calculated Property |
| η | 0.0001400 | Pa×s | 506.53 | Joback Calculated Property |
| η | 0.0000916 | Pa×s | 537.12 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 411.20 | K | 0.70 | NIST |
Similar Compounds
Find more compounds similar to Phenol, 4-iodo-.
Sources
- Crippen Method
- Crippen Method
- Crystalline and liquid vapour pressures of the four p-monohalophenols: A thermodynamic study of their phase transitions
- Joback Method
- McGowan Method
- NIST Webbook
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