245550-58-7

Name Glucobrassicanapin potassium salt
CAS 245550-58-7
Molecular Formula C12H22KNO9S2
MDL Number MFCD31808253
Molecular Weight 427.52
MOL File 245550-58-7.mol
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Chemical Properties

storage temp.  -20°C
Major Application food and beverages
InChI 1S/C12H21NO9S2.K/c1-2-3-4-5-8(13-22-24(18,19)20)23-12-11(17)10(16)9(15)7(6-14)21-12;/h2,5,7,9-17H,1,3-4,6H2,(H,18,19,20);/q;+1/p-1
InChIKey OXRJEHDNQUTOTG-UHFFFAOYSA-M
SMILES [K+].[S](=O)(=O)([O-])ONC(=CCCC=C)SC1OC(C(C(C1O)O)O)CO

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H317
Precautionary statements  P280-P302+P352
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Skin Sens. 1

Hazard Information

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