- InChI
- InChI=1S/C10H14O2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2
- InChI Key
- LODRGECCKZZTEQ-UHFFFAOYSA-N
- Formula
- C10H14O2
- SMILES
- OCC(CO)Cc1ccccc1
- Molecular Weight1
- 166.22
- CAS
- 2612-30-8
- 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).
- 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° | -130.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -322.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.10 | kJ/mol | Joback Calculated Property |
| log10WS | -1.40 | Crippen Calculated Property | |
| logPoct/wat | 0.830 | Crippen Calculated Property | |
| McVol | 139.740 | ml/mol | McGowan Calculated Property |
| Pc | 3650.93 | kPa | Joback Calculated Property |
| Tboil | 638.80 | K | Joback Calculated Property |
| Tc | 824.88 | K | Joback Calculated Property |
| Tfus | 341.00 ± 2.00 | K | NIST |
| Vc | 0.519 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [363.49; 418.24] | J/mol×K | [638.80; 824.88] | 
|
| Cp,gas | 363.49 | J/mol×K | 638.80 | Joback Calculated Property |
| Cp,gas | 374.01 | J/mol×K | 669.81 | Joback Calculated Property |
| Cp,gas | 383.94 | J/mol×K | 700.83 | Joback Calculated Property |
| Cp,gas | 393.30 | J/mol×K | 731.84 | Joback Calculated Property |
| Cp,gas | 402.12 | J/mol×K | 762.86 | Joback Calculated Property |
| Cp,gas | 410.42 | J/mol×K | 793.87 | Joback Calculated Property |
| Cp,gas | 418.24 | J/mol×K | 824.88 | Joback Calculated Property |
| η | [0.0000213; 0.0180173] | Pa×s | [335.52; 638.80] |
|
| η | 0.0180173 | Pa×s | 335.52 | Joback Calculated Property |
| η | 0.0028092 | Pa×s | 386.07 | Joback Calculated Property |
| η | 0.0006735 | Pa×s | 436.61 | Joback Calculated Property |
| η | 0.0002172 | Pa×s | 487.16 | Joback Calculated Property |
| η | 0.0000866 | Pa×s | 537.71 | Joback Calculated Property |
| η | 0.0000405 | Pa×s | 588.25 | Joback Calculated Property |
| η | 0.0000213 | Pa×s | 638.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Propanediol, 2-(phenylmethyl)-.
Sources
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