1,2,4-Benzenetricarboxylic acid, tris(2-ethylhexyl) ester


Chemical Name: 1,2,4-Benzenetricarboxylic acid, tris(2-ethylhexyl) ester
CAS Number: 3319-31-1
Product Number: AG003V75(AGN-PC-05WM6Z)
Synonyms:
MDL No:
Molecular Formula: C33H54O6
Molecular Weight: 546.7783

Identification/Properties


Properties
BP:
414°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
546.789g/mol
XLogP3:
10.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
24
Exact Mass:
546.392g/mol
Monoisotopic Mass:
546.392g/mol
Topological Polar Surface Area:
78.9A^2
Heavy Atom Count:
39
Formal Charge:
0
Complexity:
677
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H312-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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