- InChI
- InChI=1S/C7H7ClO2/c1-4-2-5(9)7(8)6(10)3-4/h2-3,9-10H,1H3
- InChI Key
- HLQYXRVJOUOMFF-UHFFFAOYSA-N
- Formula
- C7H7ClO2
- SMILES
- Cc1cc(O)c(Cl)c(O)c1
- Molecular Weight1
- 158.58
- CAS
- 56021-31-9
- 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).
- Inp : Non-polar retention indices.
- 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° | -210.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -333.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.53 | kJ/mol | Joback Calculated Property |
| log10WS | -1.73 | Crippen Calculated Property | |
| logPoct/wat | 2.060 | Crippen Calculated Property | |
| McVol | 109.710 | ml/mol | McGowan Calculated Property |
| Pc | 5800.57 | kPa | Joback Calculated Property |
| Inp | [1439.50; 1439.50] |
|
|
| Inp | 1439.50 | NIST | |
| Inp | 1439.50 | NIST | |
| Tboil | 589.89 | K | Joback Calculated Property |
| Tc | 838.26 | K | Joback Calculated Property |
| Tfus | 460.95 | K | Joback Calculated Property |
| Vc | 0.300 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [245.41; 286.13] | J/mol×K | [589.89; 838.26] |
|
| Cp,gas | 245.41 | J/mol×K | 589.89 | Joback Calculated Property |
| Cp,gas | 253.38 | J/mol×K | 631.28 | Joback Calculated Property |
| Cp,gas | 260.68 | J/mol×K | 672.68 | Joback Calculated Property |
| Cp,gas | 267.45 | J/mol×K | 714.07 | Joback Calculated Property |
| Cp,gas | 273.85 | J/mol×K | 755.47 | Joback Calculated Property |
| Cp,gas | 280.03 | J/mol×K | 796.86 | Joback Calculated Property |
| Cp,gas | 286.13 | J/mol×K | 838.26 | Joback Calculated Property |
| η | [0.0000089; 0.0001643] | Pa×s | [460.95; 589.89] |
|
| η | 0.0001643 | Pa×s | 460.95 | Joback Calculated Property |
| η | 0.0000907 | Pa×s | 482.44 | Joback Calculated Property |
| η | 0.0000527 | Pa×s | 503.93 | Joback Calculated Property |
| η | 0.0000320 | Pa×s | 525.42 | Joback Calculated Property |
| η | 0.0000202 | Pa×s | 546.91 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 568.40 | Joback Calculated Property |
| η | 0.0000089 | Pa×s | 589.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chloro-5-methylbenzene-1,3-diol.
Sources
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