- InChI
- InChI=1S/C6H3I2NO3/c7-4-1-3(9(11)12)2-5(8)6(4)10/h1-2,10H
- InChI Key
- UVGTXNPVQOQFQW-UHFFFAOYSA-N
- Formula
- C6H3I2NO3
- SMILES
- O=[N+]([O-])c1cc(I)c(O)c(I)c1
- Molecular Weight1
- 390.90
- CAS
- 305-85-1
- Other Names
-
- Phenol, 2,6-diiodo-4-nitro-
- Ancylol
- Diisophenol
- Disofen
- DNP
- Disophenol
- ω : Acentric Factor.
- 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).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.6147 | Relay (1.0) Calculated Property | |
| ΔfG° | 89.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 51.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.75 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.510 | Crippen Calculated Property | |
| McVol | 146.570 | ml/mol | McGowan Calculated Property |
| Pc | 5281.57 | kPa | Joback Calculated Property |
| Tboil | 560.09 | K | Relay (1.0) Calculated Property |
| Tc | 932.23 | K | Relay (1.0) Calculated Property |
| Tfus | 464.51 | K | Relay (1.0) Calculated Property |
| Vc | 0.441 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.77; 307.02] | J/mol×K | [792.06; 1116.39] | 
|
| Cp,gas | 268.77 | J/mol×K | 792.06 | Joback Calculated Property |
| Cp,gas | 274.52 | J/mol×K | 846.11 | Joback Calculated Property |
| Cp,gas | 280.18 | J/mol×K | 900.17 | Joback Calculated Property |
| Cp,gas | 286.01 | J/mol×K | 954.22 | Joback Calculated Property |
| Cp,gas | 292.25 | J/mol×K | 1008.28 | Joback Calculated Property |
| Cp,gas | 299.17 | J/mol×K | 1062.33 | Joback Calculated Property |
| Cp,gas | 307.02 | J/mol×K | 1116.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Diiodo-4-nitrophenol.
Sources
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