- InChI
- InChI=1S/C10H12O3S/c1-13-10-5-3-9(4-6-10)7-8-14(2,11)12/h3-8H,1-2H3/b8-7+
- InChI Key
- ASRRXCMJEGWVQS-BQYQJAHWSA-N
- Formula
- C10H12O3S
- SMILES
- COc1ccc(C=CS(C)(=O)=O)cc1
- Molecular Weight1
- 212.26
- CAS
- 70784-98-4
- Other Names
-
- Benzene, 1-methoxy-4-[2-(methylsulfonyl)ethenyl]-
- 4-Methoxystyryl-methyl-sulfon
- 4-Methoxystyryl-methyl-sulfone
- 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).
- IE : Ionization energy (eV).
- 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° | -357.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -493.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.80 | kJ/mol | Joback Calculated Property |
| IE | 8.52 | eV | NIST |
| log10WS | -2.16 | Crippen Calculated Property | |
| logPoct/wat | 1.711 | Crippen Calculated Property | |
| McVol | 157.660 | ml/mol | McGowan Calculated Property |
| Pc | 3577.07 | kPa | Joback Calculated Property |
| Tboil | 534.22 | K | Joback Calculated Property |
| Tc | 741.12 | K | Joback Calculated Property |
| Tfus | 297.11 | K | Joback Calculated Property |
| Vc | 0.612 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [343.26; 416.29] | J/mol×K | [534.22; 741.12] | 
|
| Cp,gas | 343.26 | J/mol×K | 534.22 | Joback Calculated Property |
| Cp,gas | 357.34 | J/mol×K | 568.70 | Joback Calculated Property |
| Cp,gas | 370.65 | J/mol×K | 603.19 | Joback Calculated Property |
| Cp,gas | 383.19 | J/mol×K | 637.67 | Joback Calculated Property |
| Cp,gas | 394.97 | J/mol×K | 672.15 | Joback Calculated Property |
| Cp,gas | 406.00 | J/mol×K | 706.63 | Joback Calculated Property |
| Cp,gas | 416.29 | J/mol×K | 741.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(p-Methoxyphenyl)vinylmethylsulfone.
Sources
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