(S)-3-(Allylsulfinyl)-L-alanin
Bezeichnung:(S)-3-(Allylsulfinyl)-L-alanin
CAS-Nr556-27-4
Englisch Name:(S)-3-(Allylsulphinyl)-L-alanine
CBNumberCB6301738
SummenformelC6H11NO3S
Molgewicht177.22
MOL-Datei556-27-4.mol
Synonyma
(S)-3-(Allylsulfinyl)-L-alanin
(S)-3-(Allylsulfinyl)-L-alanin physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 164-166° (effervescence) |
| alpha | D20 +63.5° (c = 2) |
| Siedepunkt | 416.1±45.0 °C(Predicted) |
| Dichte | 1.205 (estimate) |
| Brechungsindex | 1.5500 (estimate) |
| storage temp. | Keep in dark place,Inert atmosphere,Store in freezer, under -20°C |
| Löslichkeit | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. |
| Aggregatzustand | solid |
| pka | 1.88±0.10(Predicted) |
| Merck | 13,259 |
| InChI | InChI=1/C6H11NO3S/c1-2-3-11(10)4-5(7)6(8)9/h2,5H,1,3-4,7H2,(H,8,9)/t5-,11-/s3 |
| InChIKey | XUHLIQGRKRUKPH-DYEAUMGKSA-N |
| SMILES | C(O)(=O)[C@H](C[S@](CC=C)=O)N |&1:3,5,r| |
| LogP | -0.478 (est) |
| CAS Datenbank | 556-27-4(CAS DataBase Reference) |
