- InChI
- InChI=1S/C10H12O5/c1-13-7-4-6(10(12)15-3)5-8(14-2)9(7)11/h4-5,11H,1-3H3
- InChI Key
- ZMXJAEGJWHJMGX-UHFFFAOYSA-N
- Formula
- C10H12O5
- SMILES
- COC(=O)c1cc(OC)c(O)c(OC)c1
- Molecular Weight1
- 212.20
- CAS
- 884-35-5
- Other Names
-
- Methyl syringate
- Methyl 4-hydroxy-3,5-dimethoxybenzoate
- Syringic acid monomethyl ester
- Methyl 3,5-dimethoxy-4-hydroxybenzoate
- Methyl syringoate
- 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.
- 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° | -472.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -722.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.44 | kJ/mol | Joback Calculated Property |
| log10WS | -1.50 | Crippen Calculated Property | |
| logPoct/wat | 1.196 | Crippen Calculated Property | |
| McVol | 153.050 | ml/mol | McGowan Calculated Property |
| Pc | 3395.98 | kPa | Joback Calculated Property |
| Inp | [1725.00; 1780.00] |
|
|
| Inp | 1725.00 | NIST | |
| Inp | 1744.00 | NIST | |
| Inp | 1744.00 | NIST | |
| Inp | 1744.00 | NIST | |
| Inp | Outlier 1780.00 | NIST | |
| Inp | 1744.00 | NIST | |
| I | [2933.00; 2957.00] |
|
|
| I | 2957.00 | NIST | |
| I | 2957.00 | NIST | |
| I | 2933.00 | NIST | |
| I | 2933.00 | NIST | |
| I | 2957.00 | NIST | |
| Tboil | 666.59 | K | Joback Calculated Property |
| Tc | 886.20 | K | Joback Calculated Property |
| Tfus | 482.26 | K | Joback Calculated Property |
| Vc | 0.513 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [395.06; 454.70] | J/mol×K | [666.59; 886.20] |
|
| Cp,gas | 395.06 | J/mol×K | 666.59 | Joback Calculated Property |
| Cp,gas | 406.51 | J/mol×K | 703.19 | Joback Calculated Property |
| Cp,gas | 417.33 | J/mol×K | 739.79 | Joback Calculated Property |
| Cp,gas | 427.55 | J/mol×K | 776.40 | Joback Calculated Property |
| Cp,gas | 437.18 | J/mol×K | 813.00 | Joback Calculated Property |
| Cp,gas | 446.23 | J/mol×K | 849.60 | Joback Calculated Property |
| Cp,gas | 454.70 | J/mol×K | 886.20 | Joback Calculated Property |
| η | [0.0000149; 0.0001758] | Pa×s | [482.26; 666.59] |
|
| η | 0.0001758 | Pa×s | 482.26 | Joback Calculated Property |
| η | 0.0001030 | Pa×s | 512.98 | Joback Calculated Property |
| η | 0.0000641 | Pa×s | 543.70 | Joback Calculated Property |
| η | 0.0000419 | Pa×s | 574.42 | Joback Calculated Property |
| η | 0.0000287 | Pa×s | 605.15 | Joback Calculated Property |
| η | 0.0000203 | Pa×s | 635.87 | Joback Calculated Property |
| η | 0.0000149 | Pa×s | 666.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzoic acid, 4-hydroxy-3,5-dimethoxy-, methyl ester.
Sources
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.