- InChI
- InChI=1S/C7H9NO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5,8H2
- InChI Key
- VYFOAVADNIHPTR-UHFFFAOYSA-N
- Formula
- C7H9NO
- SMILES
- Nc1ccccc1CO
- Molecular Weight1
- 123.15
- CAS
- 5344-90-1
- Other Names
-
- Benzyl alcohol, o-amino-
- o-(Hydroxymethyl)aniline
- o-Aminobenzyl alcohol
- o-Aminobenzylic alcohol
- o-Aminophenylcarbinol
- Benzenemethanol, 2-amino-
- 2-Aminobenzenemethanol
- (2-Aminophenyl)methanol
- NSC 1173
- (o-Aminophenyl)methanol
- 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° | 40.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -81.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.43 | kJ/mol | Joback Calculated Property |
| log10WS | -1.25 | Crippen Calculated Property | |
| logPoct/wat | 0.761 | Crippen Calculated Property | |
| McVol | 101.580 | ml/mol | McGowan Calculated Property |
| Pc | 4924.59 | kPa | Joback Calculated Property |
| Tboil | [548.00; 548.20] | K |
|
| Tboil | 548.20 | K | NIST |
| Tboil | 548.00 ± 5.00 | K | NIST |
| Tc | 767.32 | K | Joback Calculated Property |
| Tfus | 357.00 | K | NIST |
| Vc | 0.367 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [230.88; 278.97] | J/mol×K | [555.93; 767.32] |
|
| Cp,gas | 230.88 | J/mol×K | 555.93 | Joback Calculated Property |
| Cp,gas | 240.23 | J/mol×K | 591.16 | Joback Calculated Property |
| Cp,gas | 249.02 | J/mol×K | 626.39 | Joback Calculated Property |
| Cp,gas | 257.26 | J/mol×K | 661.62 | Joback Calculated Property |
| Cp,gas | 264.99 | J/mol×K | 696.85 | Joback Calculated Property |
| Cp,gas | 272.21 | J/mol×K | 732.09 | Joback Calculated Property |
| Cp,gas | 278.97 | J/mol×K | 767.32 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [433.00; 435.20] | K | [1.00; 2.00] |
|
| Tboilr | 433.00 | K | 1.00 | NIST |
| Tboilr | 435.20 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to 2-Aminobenzyl alcohol.
Sources
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