- InChI
- InChI=1S/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H2
- InChI Key
- CWLKGDAVCFYWJK-UHFFFAOYSA-N
- Formula
- C6H7NO
- SMILES
- Nc1cccc(O)c1
- Molecular Weight1
- 109.13
- CAS
- 591-27-5
- Other Names
-
- 1-amino-3-hydroxybenzene
- 3-Amino-1-hydroxybenzene
- 3-aminophenol
- 3-hydroxyaniline
- 3-hydroxybenzenamine
- Basf ursol eg
- C.I. 76545
- C.I. Oxidation Base 7
- Fouramine EG
- Fourrine 65
- Fourrine EG
- Furro EG
- Futramine EG
- NSC 1546
- Nako TEG
- Pelagol EG
- Renal EG
- Tertral EG
- Ursol EG
- Zoba EG
- m-Aminofenol
- m-aminophenol
- m-hydroxyaminobenzene
- m-hydroxyaniline
- m-hydroxyphenylamine
- phenol, m-amino-
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ω | 0.5931 | Relay (1.0) Calculated Property | |
| PAff | 898.80 | kJ/mol | NIST |
| BasG | 866.90 | kJ/mol | NIST |
| ΔcH°solid | [-3167.40; -3161.20] | kJ/mol |
|
| ΔcH°solid | -3161.20 ± 1.20 | kJ/mol | NIST |
| ΔcH°solid | -3167.40 ± 0.60 | kJ/mol | NIST |
| ΔfG° | 23.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | [-98.60; -89.40] | kJ/mol |
|
| ΔfH°gas | -98.60 ± 1.60 | kJ/mol | NIST |
| ΔfH°gas | -89.40 ± 1.60 | kJ/mol | NIST |
| ΔfH°solid | [-200.20; -194.10] | kJ/mol |
|
| ΔfH°solid | -200.20 ± 1.20 | kJ/mol | NIST |
| ΔfH°solid | -194.10 ± 1.00 | kJ/mol | NIST |
| ΔfusH° | 27.60 | kJ/mol | Synthesis and characterization of novel binary organic monotectic and eutectic alloys |
| ΔsubH° | [101.60; 104.70] | kJ/mol |
|
| ΔsubH° | 101.60 ± 0.90 | kJ/mol | NIST |
| ΔsubH° | 101.60 ± 0.90 | kJ/mol | NIST |
| ΔsubH° | 104.70 ± 1.20 | kJ/mol | NIST |
| ΔsubH° | 104.70 ± 1.20 | kJ/mol | NIST |
| ΔvapH° | 77.64 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.974 | Crippen Calculated Property | |
| McVol | 87.490 | ml/mol | McGowan Calculated Property |
| Pc | 6328.92 | kPa | Joback Calculated Property |
| Inp | [1335.00; 1335.00] |
|
|
| Inp | 1335.00 | NIST | |
| Inp | 1335.00 | NIST | |
| Inp | 1335.00 | NIST | |
| Inp | 1335.00 | NIST | |
| Tboil | 553.10 | K | Relay (1.0) Calculated Property |
| Tc | 803.94 | K | Relay (1.0) Calculated Property |
| Tfus | [394.00; 398.00] | K |
|
| Tfus | 394.63 | K | Vapour pressures and thermodynamic stability of the three aminophenol isomers |
| Tfus | 394.00 ± 0.50 | K | NIST |
| Tfus | 398.00 ± 1.00 | K | NIST |
| Tfus | 396.00 ± 0.20 | K | NIST |
| Vc | 0.272 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [191.24; 237.03] | J/mol×K | [516.71; 762.30] |
|
| Cp,gas | 191.24 | J/mol×K | 516.71 | Joback Calculated Property |
| Cp,gas | 200.64 | J/mol×K | 557.64 | Joback Calculated Property |
| Cp,gas | 209.21 | J/mol×K | 598.57 | Joback Calculated Property |
| Cp,gas | 217.04 | J/mol×K | 639.51 | Joback Calculated Property |
| Cp,gas | 224.22 | J/mol×K | 680.44 | Joback Calculated Property |
| Cp,gas | 230.86 | J/mol×K | 721.37 | Joback Calculated Property |
| Cp,gas | 237.03 | J/mol×K | 762.30 | Joback Calculated Property |
| ΔfusH | [21.95; 23.90] | kJ/mol | [390.70; 399.00] |
|
| ΔfusH | 23.90 | kJ/mol | 390.70 | NIST |
| ΔfusH | 22.97 | kJ/mol | 396.00 | NIST |
| ΔfusH | 21.95 | kJ/mol | 396.80 | NIST |
| ΔfusH | 22.98 | kJ/mol | 399.00 | NIST |
| ΔfusH | 22.98 | kJ/mol | 399.00 | NIST |
| ΔsubH | 98.80 ± 0.90 | kJ/mol | 335.00 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [437.00; 437.20] | K | [1.50; 1.50] |
|
| Tboilr | 437.20 | K | 1.50 | NIST |
| Tboilr | 437.00 | K | 1.50 | NIST |
Similar Compounds
Find more compounds similar to Phenol, 3-amino-.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Heat capacities of aqueous polar aromatic compounds over a wide range of conditions. Part II: dihydroxybenzenes, aminophenols, diaminobenzenes
- Vapour pressures and thermodynamic stability of the three aminophenol isomers
- Synthesis and characterization of novel binary organic monotectic and eutectic alloys
- Joback Method
- McGowan Method
- NIST Webbook
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