40349-50-6
Product Name:
3-(2,5-DIOXO-2,5-DIHYDRO-PYRROL-1-YL)-BENZOIC ACID METHYL ESTER
Formula:
C12H9NO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 231.20 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 231.05315777 g/mol |
| Monoisotopic Mass | 231.05315777 g/mol |
| Topological Polar Surface Area | 63.7 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 370 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |