- InChI
- InChI=1S/C7H7ClO/c1-5-3-2-4-6(8)7(5)9/h2-4,9H,1H3
- InChI Key
- YPNZJHFXFVLXSE-UHFFFAOYSA-N
- Formula
- C7H7ClO
- SMILES
- Cc1cccc(Cl)c1O
- Molecular Weight1
- 142.58
- CAS
- 87-64-9
- Other Names
-
- o-Cresol, 6-chloro-
- 2-Chloro-6-methylphenol
- 2-Methyl-6-chlorophenol
- 6-Chloro-o-cresol
- 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° | -55.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -155.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.51 | kJ/mol | Joback Calculated Property |
| log10WS | -2.18 | Crippen Calculated Property | |
| logPoct/wat | 2.354 | Crippen Calculated Property | |
| McVol | 103.840 | ml/mol | McGowan Calculated Property |
| Pc | 4678.49 | kPa | Joback Calculated Property |
| Tboil | 509.27 | K | Joback Calculated Property |
| Tc | 746.12 | K | Joback Calculated Property |
| Tfus | 349.23 | K | Joback Calculated Property |
| Vc | 0.335 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [206.51; 253.43] | J/mol×K | [509.27; 746.12] | 
|
| Cp,gas | 206.51 | J/mol×K | 509.27 | Joback Calculated Property |
| Cp,gas | 215.97 | J/mol×K | 548.75 | Joback Calculated Property |
| Cp,gas | 224.67 | J/mol×K | 588.22 | Joback Calculated Property |
| Cp,gas | 232.68 | J/mol×K | 627.70 | Joback Calculated Property |
| Cp,gas | 240.10 | J/mol×K | 667.17 | Joback Calculated Property |
| Cp,gas | 246.99 | J/mol×K | 706.65 | Joback Calculated Property |
| Cp,gas | 253.43 | J/mol×K | 746.12 | Joback Calculated Property |
| η | [0.0000896; 0.0023623] | Pa×s | [349.23; 509.27] |
|
| η | 0.0023623 | Pa×s | 349.23 | Joback Calculated Property |
| η | 0.0011285 | Pa×s | 375.90 | Joback Calculated Property |
| η | 0.0005946 | Pa×s | 402.58 | Joback Calculated Property |
| η | 0.0003392 | Pa×s | 429.25 | Joback Calculated Property |
| η | 0.0002067 | Pa×s | 455.92 | Joback Calculated Property |
| η | 0.0001330 | Pa×s | 482.60 | Joback Calculated Property |
| η | 0.0000896 | Pa×s | 509.27 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 461.70 | K | 98.70 | NIST |
Similar Compounds
Find more compounds similar to Phenol, 2-chloro-6-methyl-.
Sources
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