- InChI
- InChI=1S/C7H8IN/c1-5-2-3-6(8)4-7(5)9/h2-4H,9H2,1H3
- InChI Key
- IOEHXNCBPIBDBZ-UHFFFAOYSA-N
- Formula
- C7H8IN
- SMILES
- Cc1ccc(I)cc1N
- Molecular Weight1
- 233.05
- CAS
- 83863-33-6
- Other Names
-
- Benzenamine, 5-iodo-2-methyl-
- 5-iodo-o-toluidine
- 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° | 225.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 136.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.79 | kJ/mol | Joback Calculated Property |
| log10WS | -2.73 | Crippen Calculated Property | |
| logPoct/wat | 2.182 | Crippen Calculated Property | |
| McVol | 121.530 | ml/mol | McGowan Calculated Property |
| Pc | 4140.93 | kPa | Joback Calculated Property |
| Tboil | 561.87 | K | Joback Calculated Property |
| Tc | 826.21 | K | Joback Calculated Property |
| Tfus | 361.43 | K | Joback Calculated Property |
| Vc | 0.436 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [228.57; 278.85] | J/mol×K | [561.87; 826.21] | 
|
| Cp,gas | 228.57 | J/mol×K | 561.87 | Joback Calculated Property |
| Cp,gas | 238.72 | J/mol×K | 605.93 | Joback Calculated Property |
| Cp,gas | 248.09 | J/mol×K | 649.98 | Joback Calculated Property |
| Cp,gas | 256.74 | J/mol×K | 694.04 | Joback Calculated Property |
| Cp,gas | 264.72 | J/mol×K | 738.10 | Joback Calculated Property |
| Cp,gas | 272.07 | J/mol×K | 782.16 | Joback Calculated Property |
| Cp,gas | 278.85 | J/mol×K | 826.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Amino-4-iodotoluene.
Sources
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