- InChI
- InChI=1S/C12H14O5/c1-8(13)16-7-10-4-5-11(15-3)12(6-10)17-9(2)14/h4-6H,7H2,1-3H3
- InChI Key
- SRSODAZXLUDDDY-UHFFFAOYSA-N
- Formula
- C12H14O5
- SMILES
- COc1ccc(COC(C)=O)cc1OC(C)=O
- Molecular Weight1
- 238.24
- 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).
- Inp : Non-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° | -429.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -699.24 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.63 | kJ/mol | Joback Calculated Property |
| log10WS | -2.48 | Crippen Calculated Property | |
| logPoct/wat | 1.684 | Crippen Calculated Property | |
| McVol | 176.930 | ml/mol | McGowan Calculated Property |
| Pc | 2515.07 | kPa | Joback Calculated Property |
| Inp | 1746.00 | NIST | |
| Tboil | 685.60 | K | Joback Calculated Property |
| Tc | 896.10 | K | Joback Calculated Property |
| Tfus | 443.01 | K | Joback Calculated Property |
| Vc | 0.665 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [460.63; 526.34] | J/mol×K | [685.60; 896.10] | 
|
| Cp,gas | 460.63 | J/mol×K | 685.60 | Joback Calculated Property |
| Cp,gas | 473.61 | J/mol×K | 720.68 | Joback Calculated Property |
| Cp,gas | 485.80 | J/mol×K | 755.77 | Joback Calculated Property |
| Cp,gas | 497.19 | J/mol×K | 790.85 | Joback Calculated Property |
| Cp,gas | 507.76 | J/mol×K | 825.93 | Joback Calculated Property |
| Cp,gas | 517.48 | J/mol×K | 861.01 | Joback Calculated Property |
| Cp,gas | 526.34 | J/mol×K | 896.10 | Joback Calculated Property |
| η | [0.0001162; 0.0006897] | Pa×s | [443.01; 685.60] |
|
| η | 0.0006897 | Pa×s | 443.01 | Joback Calculated Property |
| η | 0.0004528 | Pa×s | 483.44 | Joback Calculated Property |
| η | 0.0003171 | Pa×s | 523.87 | Joback Calculated Property |
| η | 0.0002338 | Pa×s | 564.31 | Joback Calculated Property |
| η | 0.0001795 | Pa×s | 604.74 | Joback Calculated Property |
| η | 0.0001425 | Pa×s | 645.17 | Joback Calculated Property |
| η | 0.0001162 | Pa×s | 685.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Hydroxy-4-methoxybenzyl alcohol, di(acetate).
Sources
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