- InChI
- InChI=1S/C7H7ClO2/c1-10-7-5(8)3-2-4-6(7)9/h2-4,9H,1H3
- InChI Key
- JMRPFKGSKYTUSD-UHFFFAOYSA-N
- Formula
- C7H7ClO2
- SMILES
- COc1c(O)cccc1Cl
- Molecular Weight1
- 158.58
- CAS
- 77102-92-2
- 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° | -160.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -288.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.92 | kJ/mol | Joback Calculated Property |
| log10WS | -1.82 | Crippen Calculated Property | |
| logPoct/wat | 2.054 | Crippen Calculated Property | |
| McVol | 109.710 | ml/mol | McGowan Calculated Property |
| Pc | 4571.55 | kPa | Joback Calculated Property |
| Tboil | 531.69 | K | Joback Calculated Property |
| Tc | 765.48 | K | Joback Calculated Property |
| Tfus | 305.00 ± 4.00 | K | NIST |
| Vc | 0.352 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [227.02; 274.04] | J/mol×K | [531.69; 765.48] | 
|
| Cp,gas | 227.02 | J/mol×K | 531.69 | Joback Calculated Property |
| Cp,gas | 236.28 | J/mol×K | 570.65 | Joback Calculated Property |
| Cp,gas | 244.90 | J/mol×K | 609.62 | Joback Calculated Property |
| Cp,gas | 252.93 | J/mol×K | 648.58 | Joback Calculated Property |
| Cp,gas | 260.42 | J/mol×K | 687.55 | Joback Calculated Property |
| Cp,gas | 267.44 | J/mol×K | 726.51 | Joback Calculated Property |
| Cp,gas | 274.04 | J/mol×K | 765.48 | Joback Calculated Property |
| η | [0.0000631; 0.0013306] | Pa×s | [371.46; 531.69] |
|
| η | 0.0013306 | Pa×s | 371.46 | Joback Calculated Property |
| η | 0.0006751 | Pa×s | 398.17 | Joback Calculated Property |
| η | 0.0003730 | Pa×s | 424.87 | Joback Calculated Property |
| η | 0.0002211 | Pa×s | 451.58 | Joback Calculated Property |
| η | 0.0001389 | Pa×s | 478.28 | Joback Calculated Property |
| η | 0.0000917 | Pa×s | 504.99 | Joback Calculated Property |
| η | 0.0000631 | Pa×s | 531.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methoxy-3-chloro-phenol.
Sources
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