885519-06-2
Product Name:
1-ACETYL-4-HYDROXY-6-INDOLE CARBOXYLIC ACID ETHYL ESTER
Formula:
C13H13NO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 247.25 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 247.08445790 g/mol |
| Monoisotopic Mass | 247.08445790 g/mol |
| Topological Polar Surface Area | 68.5 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 344 |
| 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 |