- InChI
- InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/t8-/m1/s1
- InChI Key
- IJXJGQCXFSSHNL-MRVPVSSYSA-N
- Formula
- C8H11NO
- SMILES
- NC(CO)c1ccccc1
- Molecular Weight1
- 137.18
- CAS
- 56613-80-0
- Other Names
-
- Benzeneethanol, «beta»-amino-, (R)-
- (R)-«beta»-aminophenethyl alcohol
- 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 | 0.6338 | Relay (1.0) Calculated Property | |
| ΔfG° | 56.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -105.82 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.80 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.679 | Crippen Calculated Property | |
| McVol | 115.670 | ml/mol | McGowan Calculated Property |
| Pc | 4456.32 | kPa | Joback Calculated Property |
| Tboil | 551.57 | K | Relay (1.0) Calculated Property |
| Tc | 774.63 | K | Relay (1.0) Calculated Property |
| Tfus | 317.00 | K | Relay (1.0) Calculated Property |
| Vc | 0.387 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.53; 331.92] | J/mol×K | [573.39; 784.75] | 
|
| Cp,gas | 276.53 | J/mol×K | 573.39 | Joback Calculated Property |
| Cp,gas | 287.40 | J/mol×K | 608.62 | Joback Calculated Property |
| Cp,gas | 297.57 | J/mol×K | 643.84 | Joback Calculated Property |
| Cp,gas | 307.08 | J/mol×K | 679.07 | Joback Calculated Property |
| Cp,gas | 315.94 | J/mol×K | 714.30 | Joback Calculated Property |
| Cp,gas | 324.21 | J/mol×K | 749.52 | Joback Calculated Property |
| Cp,gas | 331.92 | J/mol×K | 784.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (R)-(-)-2-Phenylglycinol.
Sources
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