ChemicalBook Product Catalog Chemical Reagents Organic reagents Esters THEICTA

THEICTA

Chemical Properties

Melting point	52-53 °C(lit.)
Boiling point	568.3±45.0 °C(Predicted)
Density	1.298±0.06 g/cm3(Predicted)
vapor pressure	0Pa at 25℃
refractive index	1.4489 (25)
Flash point	195
solubility	soluble in Methanol
form	powder to lump to clear liquid
pka	-2.66±0.20(Predicted)
color	White or Colorless to Almost white or Almost colorless
Water Solubility	1.497g/L at 20.1℃
Cosmetics Ingredients Functions	BINDING
InChI	InChI=1S/C18H21N3O9/c1-4-13(22)28-10-7-19-16(25)20(8-11-29-14(23)5-2)18(27)21(17(19)26)9-12-30-15(24)6-3/h4-6H,1-3,7-12H2
InChIKey	YIJYFLXQHDOQGW-UHFFFAOYSA-N
SMILES	N1(CCOC(=O)C=C)C(=O)N(CCOC(=O)C=C)C(=O)N(CCOC(=O)C=C)C1=O
LogP	2.61 at 25℃
EPA Substance Registry System	2-Propenoic acid, (2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tri-2,1-ethanediyl ester (40220-08-4)