- InChI
- InChI=1S/C8H10O3/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5,9H,1-2H3
- InChI Key
- XQDNFAMOIPNVES-UHFFFAOYSA-N
- Formula
- C8H10O3
- SMILES
- COc1cc(O)cc(OC)c1
- Molecular Weight1
- 154.16
- CAS
- 500-99-2
- Other Names
-
- Phloroglucinol dimethyl ether
- Taxicatigenin
- 1-Hydroxy-3,5-dimethoxybenzene
- 3,5-Dimethoxyphenol
- 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).
- ΔsubH° : Enthalpy of sublimation 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).
- 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° | -245.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -425.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.29 | kJ/mol | Joback Calculated Property |
| ΔsubH° | 101.10 ± 2.30 | kJ/mol | NIST |
| ΔvapH° | 54.17 | kJ/mol | Joback Calculated Property |
| log10WS | -1.26 | Crippen Calculated Property | |
| logPoct/wat | 1.409 | Crippen Calculated Property | |
| McVol | 117.430 | ml/mol | McGowan Calculated Property |
| Pc | 4135.61 | kPa | Joback Calculated Property |
| Inp | [1472.00; 1531.00] |
|
|
| Inp | 1531.00 | NIST | |
| Inp | 1472.00 | NIST | |
| I | [2848.00; 2858.00] |
|
|
| I | 2848.00 | NIST | |
| I | 2858.00 | NIST | |
| I | 2848.00 | NIST | |
| Tboil | 539.56 | K | Joback Calculated Property |
| Tc | 761.62 | K | Joback Calculated Property |
| Tfus | 375.04 | K | Joback Calculated Property |
| Vc | 0.378 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.41; 325.89] | J/mol×K | [539.56; 761.62] |
|
| Cp,gas | 268.41 | J/mol×K | 539.56 | Joback Calculated Property |
| Cp,gas | 279.41 | J/mol×K | 576.57 | Joback Calculated Property |
| Cp,gas | 289.80 | J/mol×K | 613.58 | Joback Calculated Property |
| Cp,gas | 299.60 | J/mol×K | 650.59 | Joback Calculated Property |
| Cp,gas | 308.87 | J/mol×K | 687.60 | Joback Calculated Property |
| Cp,gas | 317.62 | J/mol×K | 724.61 | Joback Calculated Property |
| Cp,gas | 325.89 | J/mol×K | 761.62 | Joback Calculated Property |
| η | [0.0000450; 0.0009897] | Pa×s | [375.04; 539.56] |
|
| η | 0.0009897 | Pa×s | 375.04 | Joback Calculated Property |
| η | 0.0004960 | Pa×s | 402.46 | Joback Calculated Property |
| η | 0.0002715 | Pa×s | 429.88 | Joback Calculated Property |
| η | 0.0001597 | Pa×s | 457.30 | Joback Calculated Property |
| η | 0.0000998 | Pa×s | 484.72 | Joback Calculated Property |
| η | 0.0000656 | Pa×s | 512.14 | Joback Calculated Property |
| η | 0.0000450 | Pa×s | 539.56 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 446.70 | K | 2.30 | NIST |
Similar Compounds
Find more compounds similar to Phenol, 3,5-dimethoxy-.
Sources
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