548-54-9

Name violacein
CAS 548-54-9
Molecular Formula C20H13N3O3
MDL Number MFCD01718468
Molecular Weight 343.34
MOL File 548-54-9.mol

Chemical Properties

Melting point  >350 °C (decomp)
Boiling point  821.4±65.0 °C(Predicted)
density  1.549±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  H2O: insoluble
form  A solid
pka 9.72±0.40(Predicted)
color  Brown to black
Water Solubility  H2O: insoluble
acetone: soluble
ethanol: soluble
methanol: soluble
Cosmetics Ingredients Functions ANTIOXIDANT
ANTIMICROBIAL
COLORANT
InChI 1S/C20H13N3O3/c24-10-5-6-15-12(7-10)14(9-21-15)17-8-13(19(25)23-17)18-11-3-1-2-4-16(11)22-20(18)26/h1-9,21,24H,(H,22,26)(H,23,25)/b18-13-
InChIKey XAPNKXIRQFHCHN-AQTBWJFISA-N
SMILES N1C(=C\C(=C4/c5c(cccc5)NC/4=O)\C1=O)c2c3c([nH]c2)ccc(c3)O

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier