- InChI
- InChI=1S/C12H11NO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9H,13H2
- InChI Key
- UCSYVYFGMFODMY-UHFFFAOYSA-N
- Formula
- C12H11NO
- SMILES
- Nc1cccc(Oc2ccccc2)c1
- Molecular Weight1
- 185.22
- CAS
- 3586-12-7
- Other Names
-
- m-Phenoxyaniline
- 3-Aminodiphenyl ether
- m-Aminophenyl phenyl ether
- Aniline, m-phenoxy-
- 3-Phenoxyaniline
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 226.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 72.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.57 | kJ/mol | Joback Calculated Property |
| log10WS | -2.74 | Crippen Calculated Property | |
| logPoct/wat | 3.061 | Crippen Calculated Property | |
| McVol | 148.270 | ml/mol | McGowan Calculated Property |
| Pc | 3530.46 | kPa | Joback Calculated Property |
| Tboil | [588.00; 602.70] | K |
|
| Tboil | 602.70 | K | NIST |
| Tboil | 588.20 | K | NIST |
| Tboil | 588.00 | K | NIST |
| Tc | 881.74 | K | Joback Calculated Property |
| Tfus | 310.00 | K | NIST |
| Vc | 0.538 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [359.85; 431.47] | J/mol×K | [627.25; 881.74] |
|
| Cp,gas | 359.85 | J/mol×K | 627.25 | Joback Calculated Property |
| Cp,gas | 374.56 | J/mol×K | 669.67 | Joback Calculated Property |
| Cp,gas | 388.09 | J/mol×K | 712.08 | Joback Calculated Property |
| Cp,gas | 400.50 | J/mol×K | 754.50 | Joback Calculated Property |
| Cp,gas | 411.83 | J/mol×K | 796.91 | Joback Calculated Property |
| Cp,gas | 422.13 | J/mol×K | 839.33 | Joback Calculated Property |
| Cp,gas | 431.47 | J/mol×K | 881.74 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 424.50 ± 1.50 | K | 0.40 | NIST |
Similar Compounds
Find more compounds similar to Benzenamine, 3-phenoxy-.
Sources
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