(S)-3-(Allylsulphinyl)-L-alanine
Catalog No: FT-0653863
CAS No: 556-27-4
- Molecular Formula: 177.22
- Formula Weight: C6H11NO3S
- Inchl Key: XUHLIQGRKRUKPH-ITZCMCNPSA-N
- Inchl: InChI=1S/C6H11NO3S/c1-2-3-11(10)4-5(7)6(8)9/h2,5H,1,3-4,7H2,(H,8,9)/t5-,11?/m0/s1
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Symbol: | GHS07 |
|---|---|
| CAS: | 556-27-4 |
| Flash_Point: | 205.5±28.7 °C |
| Product_Name: | 3-(Allylsulfinyl)-L-alanine |
| Bolling_Point: | 416.1±45.0 °C at 760 mmHg |
| FW: | 177.221 |
| Melting_Point: | 165ºC |
| MF: | C6H11NO3S |
| Density: | 1.4±0.1 g/cm3 |
| Refractive_Index: | 1.579 |
|---|---|
| Vapor_Pressure: | 0.0±2.1 mmHg at 25°C |
| Flash_Point: | 205.5±28.7 °C |
| LogP: | -0.48 |
| Bolling_Point: | 416.1±45.0 °C at 760 mmHg |
| FW: | 177.221 |
| PSA: | 99.60000 |
| Computational_Chemistry: | ['四计算化学数据 ', '1 . XlogP -35 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 5 ', '5 . TPSA 804 ', '6 . Heavy Atom Count 11 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 181 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 1 ', '11 . Undefined Atom Stereocenter Count 1 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1'] |
| Melting_Point: | 165ºC |
| MF: | C6H11NO3S |
| Exact_Mass: | 177.045959 |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 4349 ', '2 . Molar volume （m3/mol）1308 ', '3 . Parachor （902K）3790 ', '4 . Surface tension 703 ', '5 . Polarizability 1724'] |
| Density: | 1.4±0.1 g/cm3 |
| More_Info: | ['一物性数据 ', '1性质半Water 合物，无臭味，从稀丙酮中析出针晶束。 ', '2. Melting point164～166℃(起泡)。 ', '3旋光度+635℃(c=2) ', '4易Soluble in Water ，Insoluble in 无Water Ethanol 氯仿丙酮 Ethyl ether 苯。'] |
| Symbol: | GHS07 |
|---|---|
| Risk_Statements(EU): | R36/37/38 |
| HS_Code: | 2942000000 |
| WGK_Germany: | 3 |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi:Irritant; |
| Warning_Statement: | P261-P305 + P351 + P338 |
| Safety_Statements: | H315-H319-H335 |
