![[(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate (CAS: 138249-07-7) - Chemical Structure and Molecular Formula](/static/img/prod-pic/FT-0770807.gif "[(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate chemical structure")
[(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate
Catalog No: FT-0770807
CAS No: 138249-07-7
- Chemical Name: [(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate
- Molecular Formula: C11H14O4S
- Molecular Weight: 242.29
- InChI Key: YQSCDBZHHLIPOI-SNVBAGLBSA-N
- InChI: InChI=1S/C11H14O4S/c1-3-10(12)8-15-16(13,14)11-6-4-9(2)5-7-11/h3-7,10,12H,1,8H2,2H3/t10-/m1/s1
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | 58-63ºC |
|---|---|
| FW: | 242.29100 |
| CAS: | 138249-07-7 |
| MF: | C11H14O4S |
| Flash_Point: | 194.7ºC |
| Product_Name: | [(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate |
| Bolling_Point: | 398.3ºC at 760 mmHg |
| Density: | 1.234 g/cm3 |
| FW: | 242.29100 |
|---|---|
| Refractive_Index: | 1.541 |
| Vapor_Pressure: | 4.65E-07mmHg at 25°C |
| Flash_Point: | 194.7ºC |
| LogP: | 2.32800 |
| Bolling_Point: | 398.3ºC at 760 mmHg |
| More_Info: | ['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）58-63 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 72 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :309 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :1 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 58-63ºC |
| MF: | C11H14O4S |
| Exact_Mass: | 242.06100 |
| Molecular_Structure: | ['1 . Molar refractive index 6173 ', '2 . Molar volume （m3/mol）1963 ', '3 . Parachor （902K）5062 ', '4 . Surface tension 442 ', '5 . Polarizability 2447'] |
| Density: | 1.234 g/cm3 |
| PSA: | 71.98000 |
| Safety_Statements: | 26 24 25 |
|---|---|
| Hazard_Codes: | Xi: Irritant; |
| Risk_Statements(EU): | R36/37/38 |
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