63468-11-1
Product Name:
1,2,4-Benzenetricarboxylic Acid 2,4-Bis(2-ethylhexyl) Ester
Formula:
C25H38O6
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 233.33 Ų [M+Na]+ 218.39 Ų [M+H]+ 222.86 Ų [M-H]- |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 434.6 g/mol |
|---|---|
| XLogP3 | 7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 17 |
| Exact Mass | 434.26683893 g/mol |
| Monoisotopic Mass | 434.26683893 g/mol |
| Topological Polar Surface Area | 89.9 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 546 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |