129572-48-1

Name 5-Bromo-4-chloro-3-indolyl-N-acetyl-beta-D-galactosaminide
CAS 129572-48-1
EINECS(EC#) 1533716-785-6
Molecular Formula C16H17BrClN2O6-
MDL Number MFCD00083260
Molecular Weight 448.67
MOL File 129572-48-1.mol

Chemical Properties

Melting point  ≥220 °C(lit.)
Boiling point  777.5±60.0 °C(Predicted)
density  1.78±0.1 g/cm3(Predicted)
storage temp.  −20°C
solubility  DMF: soluble
form  powder
pka 12.87±0.70(Predicted)
color  Pale Grey to Light Grey
InChI InChI=1S/C16H18BrClN2O6/c1-6(22)20-13-15(24)14(23)10(5-21)26-16(13)25-9-4-19-8-3-2-7(17)12(18)11(8)9/h2-4,10,13-16,19,21,23-24H,5H2,1H3,(H,20,22)
InChIKey SUWPNTKTZYIFQT-UHFFFAOYSA-N
SMILES C(NC1C(O)C(O)C(CO)OC1OC1C2=C(NC=1)C=CC(Br)=C2Cl)(=O)C
CAS DataBase Reference 129572-48-1(CAS DataBase Reference)

Safety Data

WGK Germany  3
F  3-8-10
HS Code  29349990

Hazard Information

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