- InChI
- InChI=1S/C7H5ClO2/c8-6-3-5(4-9)1-2-7(6)10/h1-4,10H
- InChI Key
- VGSOCYWCRMXQAB-UHFFFAOYSA-N
- Formula
- C7H5ClO2
- SMILES
- O=Cc1ccc(O)c(Cl)c1
- Molecular Weight1
- 156.57
- CAS
- 2420-16-8
- Other Names
-
- 3-Chloro-4-hydroxybenzaldehyde
- Benzaldehyde, 3-chloro-4-hydroxy-
- 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° | -155.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -241.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.23 | kJ/mol | Joback Calculated Property |
| log10WS | -1.95 | Crippen Calculated Property | |
| logPoct/wat | 1.858 | Crippen Calculated Property | |
| McVol | 105.410 | ml/mol | McGowan Calculated Property |
| Pc | 5190.64 | kPa | Joback Calculated Property |
| Inp | [1274.00; 1301.00] |
|
|
| Inp | 1291.00 | NIST | |
| Inp | 1291.00 | NIST | |
| Inp | 1301.00 | NIST | |
| Inp | 1291.00 | NIST | |
| Inp | 1290.00 | NIST | |
| Inp | 1275.00 | NIST | |
| Inp | 1274.00 | NIST | |
| Inp | 1291.00 | NIST | |
| Inp | 1291.00 | NIST | |
| Tboil | 557.93 | K | Joback Calculated Property |
| Tc | 797.69 | K | Joback Calculated Property |
| Tfus | 391.23 | K | Joback Calculated Property |
| Vc | 0.351 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [217.03; 255.74] | J/mol×K | [557.93; 797.69] |
|
| Cp,gas | 217.03 | J/mol×K | 557.93 | Joback Calculated Property |
| Cp,gas | 224.89 | J/mol×K | 597.89 | Joback Calculated Property |
| Cp,gas | 232.07 | J/mol×K | 637.85 | Joback Calculated Property |
| Cp,gas | 238.67 | J/mol×K | 677.81 | Joback Calculated Property |
| Cp,gas | 244.76 | J/mol×K | 717.77 | Joback Calculated Property |
| Cp,gas | 250.42 | J/mol×K | 757.73 | Joback Calculated Property |
| Cp,gas | 255.74 | J/mol×K | 797.69 | Joback Calculated Property |
| η | [0.0000750; 0.0013964] | Pa×s | [391.23; 557.93] |
|
| η | 0.0013964 | Pa×s | 391.23 | Joback Calculated Property |
| η | 0.0007298 | Pa×s | 419.01 | Joback Calculated Property |
| η | 0.0004135 | Pa×s | 446.80 | Joback Calculated Property |
| η | 0.0002504 | Pa×s | 474.58 | Joback Calculated Property |
| η | 0.0001603 | Pa×s | 502.36 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 530.15 | Joback Calculated Property |
| η | 0.0000750 | Pa×s | 557.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzaldehyde, 4-hydroxy-3-chloro.
Sources
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