88162-09-8
Product Name:
1,2-Benzenedicarboxylic acid, 1-[2-(carboxymethyl)-4-oxohexyl] ester
Formula:
C16H18O7
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 322.31 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 10 |
| Exact Mass | 322.10525291 g/mol |
| Monoisotopic Mass | 322.10525291 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 457 |
| 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 |