beta-Alanine benzyl ester p-toluenesulfonate salt
Catalog No: FT-0638660
CAS No: 27019-47-2
- Chemical Name: beta-Alanine benzyl ester p-toluenesulfonate salt
- Molecular Formula: C17H21NO5S
- Molecular Weight: 351.4
- InChI Key: FRHWYVGCFUQMJR-UHFFFAOYSA-N
- InChI: InChI=1S/C10H13NO2.C7H8O3S/c11-7-6-10(12)13-8-9-4-2-1-3-5-9;1-6-2-4-7(5-3-6)11(8,9)10/h1-5H,6-8,11H2;2-5H,1H3,(H,8,9,10)
| 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 |
| Product_Name: | benzyl 3-aminopropanoate,4-methylbenzenesulfonic acid |
|---|---|
| Flash_Point: | 284.7ºC |
| Melting_Point: | 138-139°C |
| FW: | 351.417 |
| Density: | N/A |
| CAS: | 27019-47-2 |
| Bolling_Point: | 547.2ºC at 760 mmHg |
| MF: | C17H21NO5S |
| Flash_Point: | 284.7ºC |
|---|---|
| FW: | 351.417 |
| Bolling_Point: | 547.2ºC at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 115 ', '7. Heavy Atom Count :24 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :359 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :2'] |
| LogP: | 4.10140 |
| Melting_Point: | 138-139°C |
| PSA: | 115.07000 |
| MF: | C17H21NO5S |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）138-139 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow'] |
| Vapor_Pressure: | 0.00236mmHg at 25°C |
| Exact_Mass: | 351.114044 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| RIDADR: | NONH for all modes of transport |
| HS_Code: | 2922499990 |
| WGK_Germany: | 3 |
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