- InChI
- InChI=1S/C9H12O2/c1-9(11,7-10)8-5-3-2-4-6-8/h2-6,10-11H,7H2,1H3
- InChI Key
- LNCZPZFNQQFXPT-UHFFFAOYSA-N
- Formula
- C9H12O2
- SMILES
- CC(O)(CO)c1ccccc1
- Molecular Weight1
- 152.19
- CAS
- 4217-66-7
- Other Names
-
- 1,2-Propanediol, 2-phenyl-
- 1-Phenyl-1,2-propanediol
- 1-Phenylpropane-1,2-diol
- DL-2-phenylpropane-1,2-diol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | -133.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -305.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.97 | kJ/mol | Joback Calculated Property |
| log10WS | -1.39 | Crippen Calculated Property | |
| logPoct/wat | 0.886 | Crippen Calculated Property | |
| McVol | 125.650 | ml/mol | McGowan Calculated Property |
| Pc | 4173.09 | kPa | Joback Calculated Property |
| I | [2339.00; 2343.00] |
|
|
| I | 2339.00 | NIST | |
| I | 2343.00 | NIST | |
| Tboil | 613.13 | K | Joback Calculated Property |
| Tc | 807.24 | K | Joback Calculated Property |
| Tfus | 341.67 | K | Joback Calculated Property |
| Vc | 0.459 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [318.72; 369.49] | J/mol×K | [613.13; 807.24] |
|
| Cp,gas | 318.72 | J/mol×K | 613.13 | Joback Calculated Property |
| Cp,gas | 328.70 | J/mol×K | 645.48 | Joback Calculated Property |
| Cp,gas | 338.01 | J/mol×K | 677.83 | Joback Calculated Property |
| Cp,gas | 346.71 | J/mol×K | 710.18 | Joback Calculated Property |
| Cp,gas | 354.82 | J/mol×K | 742.53 | Joback Calculated Property |
| Cp,gas | 362.40 | J/mol×K | 774.89 | Joback Calculated Property |
| Cp,gas | 369.49 | J/mol×K | 807.24 | Joback Calculated Property |
| η | [0.0000261; 0.0143595] | Pa×s | [341.67; 613.13] |
|
| η | 0.0143595 | Pa×s | 341.67 | Joback Calculated Property |
| η | 0.0027111 | Pa×s | 386.91 | Joback Calculated Property |
| η | 0.0007257 | Pa×s | 432.16 | Joback Calculated Property |
| η | 0.0002494 | Pa×s | 477.40 | Joback Calculated Property |
| η | 0.0001031 | Pa×s | 522.64 | Joback Calculated Property |
| η | 0.0000491 | Pa×s | 567.89 | Joback Calculated Property |
| η | 0.0000261 | Pa×s | 613.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to dl-2-Phenyl-1,2-propanediol.
Sources
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