- InChI
- InChI=1S/C7H6Cl2O2/c1-11-7-5(9)3-2-4(8)6(7)10/h2-3,10H,1H3
- InChI Key
- OBRQSFBOZCMSTK-UHFFFAOYSA-N
- Formula
- C7H6Cl2O2
- SMILES
- COc1c(Cl)ccc(Cl)c1O
- Molecular Weight1
- 193.03
- CAS
- 77102-93-3
- 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° | -182.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -315.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.97 | kJ/mol | Joback Calculated Property |
| log10WS | -2.51 | Crippen Calculated Property | |
| logPoct/wat | 2.708 | Crippen Calculated Property | |
| McVol | 121.950 | ml/mol | McGowan Calculated Property |
| Pc | 4266.28 | kPa | Joback Calculated Property |
| Tboil | 574.10 | K | Joback Calculated Property |
| Tc | 813.27 | K | Joback Calculated Property |
| Tfus | 343.00 ± 4.00 | K | NIST |
| Vc | 0.402 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [246.37; 288.27] | J/mol×K | [574.10; 813.27] | 
|
| Cp,gas | 246.37 | J/mol×K | 574.10 | Joback Calculated Property |
| Cp,gas | 254.56 | J/mol×K | 613.96 | Joback Calculated Property |
| Cp,gas | 262.19 | J/mol×K | 653.82 | Joback Calculated Property |
| Cp,gas | 269.33 | J/mol×K | 693.68 | Joback Calculated Property |
| Cp,gas | 276.01 | J/mol×K | 733.55 | Joback Calculated Property |
| Cp,gas | 282.31 | J/mol×K | 773.41 | Joback Calculated Property |
| Cp,gas | 288.27 | J/mol×K | 813.27 | Joback Calculated Property |
| η | [0.0000460; 0.0006281] | Pa×s | [413.90; 574.10] |
|
| η | 0.0006281 | Pa×s | 413.90 | Joback Calculated Property |
| η | 0.0003560 | Pa×s | 440.60 | Joback Calculated Property |
| η | 0.0002153 | Pa×s | 467.30 | Joback Calculated Property |
| η | 0.0001375 | Pa×s | 494.00 | Joback Calculated Property |
| η | 0.0000919 | Pa×s | 520.70 | Joback Calculated Property |
| η | 0.0000639 | Pa×s | 547.40 | Joback Calculated Property |
| η | 0.0000460 | Pa×s | 574.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methoxy-3,6-dichloro-phenol.
Sources
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