- InChI
- InChI=1S/C12H11NO/c14-12-8-4-7-11(9-12)13-10-5-2-1-3-6-10/h1-9,13-14H
- InChI Key
- NDACNGSDAFKTGE-UHFFFAOYSA-N
- Formula
- C12H11NO
- SMILES
- Oc1cccc(Nc2ccccc2)c1
- Molecular Weight1
- 185.22
- CAS
- 101-18-8
- Other Names
-
- m-Hydroxydiphenylamine
- Phenol, 3-(phenylamino)-
- m-Anilinophenol
- Phenol, m-anilino-
- 3-(Phenylamino)phenol
- 3-Hydroxy-N-phenylaniline
- 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 | 0.6381 | Relay (1.0) Calculated Property | |
| ΔfG° | 209.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 22.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.96 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.136 | Crippen Calculated Property | |
| McVol | 148.270 | ml/mol | McGowan Calculated Property |
| Pc | 4183.90 | kPa | Joback Calculated Property |
| Tboil | 613.20 | K | NIST |
| Tc | 940.44 | K | Relay (1.0) Calculated Property |
| Tfus | 380.84 | K | Relay (1.0) Calculated Property |
| Vc | 0.519 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [376.27; 443.12] | J/mol×K | [658.11; 914.96] | 
|
| Cp,gas | 376.27 | J/mol×K | 658.11 | Joback Calculated Property |
| Cp,gas | 389.75 | J/mol×K | 700.92 | Joback Calculated Property |
| Cp,gas | 402.08 | J/mol×K | 743.73 | Joback Calculated Property |
| Cp,gas | 413.43 | J/mol×K | 786.54 | Joback Calculated Property |
| Cp,gas | 423.95 | J/mol×K | 829.35 | Joback Calculated Property |
| Cp,gas | 433.80 | J/mol×K | 872.15 | Joback Calculated Property |
| Cp,gas | 443.12 | J/mol×K | 914.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Hydroxydiphenylamine.
Sources
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