53568-81-3
Product Name:
1,2-Benzenedicarboxylic acid, ester with 1,2,3-propanetriol
Formula:
C8H6O4.x(C3H8O3)
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COMPUTED DESCRIPTORS
| Molecular Weight | 240.21 g/mol |
|---|---|
| XLogP3 | -0.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 240.06338810 g/mol |
| Monoisotopic Mass | 240.06338810 g/mol |
| Topological Polar Surface Area | 104 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 277 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |