- InChI
- InChI=1S/C7H7ClO3S/c1-11-6-2-4-7(5-3-6)12(8,9)10/h2-5H,1H3
- InChI Key
- DTJVECUKADWGMO-UHFFFAOYSA-N
- Formula
- C7H7ClO3S
- SMILES
- COc1ccc(S(=O)(=O)Cl)cc1
- Molecular Weight1
- 206.65
- CAS
- 98-68-0
- Other Names
-
- Benzenesulfonyl chloride, p-methoxy-
- p-Anisylsulfonyl chloride
- p-Methoxybenzenesulfonyl chloride
- p-Methoxyphenylsulfonyl chloride
- 4-Methoxybenzenesulfonyl chloride
- 4-methoxybenzenesulphonyl chloride
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -474.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -564.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.54 | kJ/mol | Joback Calculated Property |
| log10WS | -2.01 | Crippen Calculated Property | |
| logPoct/wat | 1.623 | Crippen Calculated Property | |
| McVol | 131.930 | ml/mol | McGowan Calculated Property |
| Pc | 4608.87 | kPa | Joback Calculated Property |
| Tboil | 498.85 | K | Joback Calculated Property |
| Tc | 710.87 | K | Joback Calculated Property |
| Tfus | 298.30 | K | Joback Calculated Property |
| Vc | 0.512 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [256.21; 312.99] | J/mol×K | [498.85; 710.87] | 
|
| Cp,gas | 256.21 | J/mol×K | 498.85 | Joback Calculated Property |
| Cp,gas | 267.10 | J/mol×K | 534.19 | Joback Calculated Property |
| Cp,gas | 277.43 | J/mol×K | 569.52 | Joback Calculated Property |
| Cp,gas | 287.20 | J/mol×K | 604.86 | Joback Calculated Property |
| Cp,gas | 296.39 | J/mol×K | 640.19 | Joback Calculated Property |
| Cp,gas | 304.99 | J/mol×K | 675.53 | Joback Calculated Property |
| Cp,gas | 312.99 | J/mol×K | 710.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenesulfonyl chloride, 4-methoxy-.
Sources
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