- InChI
- InChI=1S/C9H12O3/c1-11-8-4-3-7(6-10)9(5-8)12-2/h3-5,10H,6H2,1-2H3
- InChI Key
- RNKOUSCCPHSCFE-UHFFFAOYSA-N
- Formula
- C9H12O3
- SMILES
- COc1ccc(CO)c(OC)c1
- Molecular Weight1
- 168.19
- CAS
- 7314-44-5
- Other Names
-
- Benzenemethanol, 2,4-dimethoxy-
- 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).
- Tboilr : Boiling point at reduced pressure (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° | -228.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -432.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.73 | kJ/mol | Joback Calculated Property |
| log10WS | -1.85 | Crippen Calculated Property | |
| logPoct/wat | 1.196 | Crippen Calculated Property | |
| McVol | 131.520 | ml/mol | McGowan Calculated Property |
| Pc | 3368.44 | kPa | Joback Calculated Property |
| Tboil | 578.98 | K | Joback Calculated Property |
| Tc | 772.90 | K | Joback Calculated Property |
| Tfus | 347.93 | K | Joback Calculated Property |
| Vc | 0.486 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [311.96; 369.75] | J/mol×K | [578.98; 772.90] | 
|
| Cp,gas | 311.96 | J/mol×K | 578.98 | Joback Calculated Property |
| Cp,gas | 322.78 | J/mol×K | 611.30 | Joback Calculated Property |
| Cp,gas | 333.13 | J/mol×K | 643.62 | Joback Calculated Property |
| Cp,gas | 343.01 | J/mol×K | 675.94 | Joback Calculated Property |
| Cp,gas | 352.41 | J/mol×K | 708.26 | Joback Calculated Property |
| Cp,gas | 361.32 | J/mol×K | 740.58 | Joback Calculated Property |
| Cp,gas | 369.75 | J/mol×K | 772.90 | Joback Calculated Property |
| η | [0.0000650; 0.0021561] | Pa×s | [347.93; 578.98] |
|
| η | 0.0021561 | Pa×s | 347.93 | Joback Calculated Property |
| η | 0.0008995 | Pa×s | 386.44 | Joback Calculated Property |
| η | 0.0004397 | Pa×s | 424.95 | Joback Calculated Property |
| η | 0.0002420 | Pa×s | 463.46 | Joback Calculated Property |
| η | 0.0001460 | Pa×s | 501.96 | Joback Calculated Property |
| η | 0.0000947 | Pa×s | 540.47 | Joback Calculated Property |
| η | 0.0000650 | Pa×s | 578.98 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 451.20 | K | 1.30 | NIST |
Similar Compounds
Find more compounds similar to 2,4-Dimethoxybenzyl alcohol.
Sources
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