- InChI
- InChI=1S/C6H7IN2/c7-5-1-3-6(9-8)4-2-5/h1-4,9H,8H2
- InChI Key
- IQMLCMKMSBMMGR-UHFFFAOYSA-N
- Formula
- C6H7IN2
- SMILES
- NNc1ccc(I)cc1
- Molecular Weight1
- 234.04
- CAS
- 13116-27-3
- 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 | 0.4459 | Relay (... Calculated Property | |
| ΔfG° | 316.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 240.80 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 19.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.77 | kJ/mol | Relay (... Calculated Property |
| IE | 7.64 | eV | Relay (... Calculated Property |
| log10WS | -1.94 | Relay (... Calculated Property | |
| logPoct/wat | 1.577 | Crippen Calculated Property | |
| McVol | 117.420 | ml/mol | McGowan Calculated Property |
| Pc | 4890.21 | kPa | Joback Calculated Property |
| Tboil | 585.00 | K | Relay (... Calculated Property |
| Tc | 864.43 | K | Relay (... Calculated Property |
| Tfus | 374.65 | K | Relay (... Calculated Property |
| Vc | 0.378 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [226.76; 272.52] | J/mol×K | [584.18; 850.53] | 
|
| Cp,gas | 226.76 | J/mol×K | 584.18 | Joback Calculated Property |
| Cp,gas | 236.24 | J/mol×K | 628.57 | Joback Calculated Property |
| Cp,gas | 244.89 | J/mol×K | 672.96 | Joback Calculated Property |
| Cp,gas | 252.78 | J/mol×K | 717.35 | Joback Calculated Property |
| Cp,gas | 259.98 | J/mol×K | 761.74 | Joback Calculated Property |
| Cp,gas | 266.53 | J/mol×K | 806.13 | Joback Calculated Property |
| Cp,gas | 272.52 | J/mol×K | 850.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Iodophenylhydrazine.
Sources
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