- InChI
- InChI=1S/C14H14O2S/c1-11-8-9-14(12(2)10-11)17(15,16)13-6-4-3-5-7-13/h3-10H,1-2H3
- InChI Key
- ZCVSDPUSEUOUHQ-UHFFFAOYSA-N
- Formula
- C14H14O2S
- SMILES
-
Cc1ccc(S(=O)(=O)c2ccccc2)c(C)c
1 - Molecular Weight1
- 246.32
- CAS
- 4212-74-2
- Other Names
-
- Sulfone, phenyl, 2,4-xylyl
- 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° | -195.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -335.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.27 | kJ/mol | Joback Calculated Property |
| log10WS | -3.79 | Crippen Calculated Property | |
| logPoct/wat | 3.136 | Crippen Calculated Property | |
| McVol | 188.690 | ml/mol | McGowan Calculated Property |
| Pc | 3173.97 | kPa | Joback Calculated Property |
| Tboil | 630.82 | K | Joback Calculated Property |
| Tc | 861.63 | K | Joback Calculated Property |
| Tfus | 358.00 ± 2.00 | K | NIST |
| Vc | 0.730 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [456.66; 537.83] | J/mol×K | [630.82; 861.63] | 
|
| Cp,gas | 456.66 | J/mol×K | 630.82 | Joback Calculated Property |
| Cp,gas | 473.14 | J/mol×K | 669.29 | Joback Calculated Property |
| Cp,gas | 488.39 | J/mol×K | 707.76 | Joback Calculated Property |
| Cp,gas | 502.46 | J/mol×K | 746.22 | Joback Calculated Property |
| Cp,gas | 515.36 | J/mol×K | 784.69 | Joback Calculated Property |
| Cp,gas | 527.14 | J/mol×K | 823.16 | Joback Calculated Property |
| Cp,gas | 537.83 | J/mol×K | 861.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dimethyldiphenylsulfone.
Sources
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