chempirical

Ethylhexyl triazone

C48H66N6O6CAS 88122-99-0823.09 g/mol

Open in Covalent MOL file
OONHNNHOONHNOON
EsterSecondary amine

Properties

Molecular formula
C48H66N6O6
Molar mass
823.09 g/mol
Exact mass
822.5044 Da
logP
12.22Crippen estimate
Polar surface area
153.7 Ų
H-bond donors / acceptors
3 / 12
Rotatable bonds
27

Identifiers

CAS number
88122-99-0
SMILES
CCCCC(CC)COC(=O)c1ccc(Nc2nc(Nc3ccc(C(=O)OCC(CC)CCCC)cc3)nc(Nc3ccc(C(=O)OCC(CC)CCCC)cc3)n2)cc1
InChIKey
JGUMTYWKIBJSTN-UHFFFAOYSA-N
InChI
InChI=1S/C48H66N6O6/c1-7-13-16-34(10-4)31-58-43(55)37-19-25-40(26-20-37)49-46-52-47(50-41-27-21-38(22-28-41)44(56)59-32-35(11-5)17-14-8-2)54-48(53-46)51-42-29-23-39(24-30-42)45(57)60-33-36(12-6)18-15-9-3/h19-30,34-36H,7-18,31-33H2,1-6H3,(H3,49,50,51,52,53,54)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Benzoic acid, 4,4′,4′′-(1,3,5-triazine-2,4,6-triyltriimino)tris-, 1,1′,1′′-tris(2-ethylhexyl) ester
  • Benzoic acid, 4,4′,4′′-(1,3,5-triazine-2,4,6-triyltriimino)tris-, tris(2-ethylhexyl) ester
  • Uvinul T 150
  • Octyl triazone
  • 2,4,6-Trianilino(p-carbo-2-ethylhexyloxy)-1,3,5-triazine
  • 2,4,6-Trianilino(p-carbo-2-ethylhexyl-1-oxy)-1,3,5-triazine
  • 2,4,6-Tris[4-(2-ethylhexyloxycarbonyl)anilino]-1,3,5-triazine
  • UVT 150
  • Uvasorb ET

Work with Ethylhexyl triazone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Iscotrizinol154702-15-580 % similar Bis(2-ethylhexyl) terephthalate6422-86-274 % similar 2-Ethylhexyl P-aminobenzoate26218-04-265 % similar 2-Ethylhexyl 4-hydroxybenzoate5153-25-365 % similar Padimate O21245-02-363 % similar Trioctyl trimellitate3319-31-161 % similar Bis(2-ethylhexyl) phthalate117-81-757 % similar 2-Ethylhexyl salicylate118-60-551 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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