- InChI
- InChI=1S/C3H7ClO2S/c1-2-3-7(4,5)6/h2-3H2,1H3
- InChI Key
- KPBSJEBFALFJTO-UHFFFAOYSA-N
- Formula
- C3H7ClO2S
- SMILES
- CCCS(=O)(=O)Cl
- Molecular Weight1
- 142.60
- CAS
- 10147-36-1
- Other Names
-
- Propane-1-sulfonyl chloride
- propanesulphonyl 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | -506.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -574.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.10 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.29 | kJ/mol | Joback Calculated Property |
| log10WS | -1.06 | Crippen Calculated Property | |
| logPoct/wat | 0.965 | Crippen Calculated Property | |
| McVol | 93.460 | ml/mol | McGowan Calculated Property |
| Pc | 5190.64 | kPa | Joback Calculated Property |
| Tboil | 450.50 ± 2.50 | K | NIST |
| Tc | 525.11 | K | Joback Calculated Property |
| Tfus | 192.05 | K | Joback Calculated Property |
| Vc | 0.379 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [149.52; 188.89] | J/mol×K | [353.25; 525.11] | 
|
| Cp,gas | 149.52 | J/mol×K | 353.25 | Joback Calculated Property |
| Cp,gas | 156.62 | J/mol×K | 381.89 | Joback Calculated Property |
| Cp,gas | 163.51 | J/mol×K | 410.54 | Joback Calculated Property |
| Cp,gas | 170.19 | J/mol×K | 439.18 | Joback Calculated Property |
| Cp,gas | 176.65 | J/mol×K | 467.83 | Joback Calculated Property |
| Cp,gas | 182.88 | J/mol×K | 496.47 | Joback Calculated Property |
| Cp,gas | 188.89 | J/mol×K | 525.11 | Joback Calculated Property |
| ΔvapH | [49.90; 60.10] | kJ/mol | [258.00; 413.00] |
|
| ΔvapH | 60.10 | kJ/mol | 258.00 | NIST |
| ΔvapH | 52.30 | kJ/mol | 317.50 | NIST |
| ΔvapH | 49.90 | kJ/mol | 413.00 | NIST |
Similar Compounds
Find more compounds similar to 1-Propanesulfonyl chloride.
Sources
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