946427-88-9
Product Name:
6-Bromo-benzo[b]thiophene-3-carboxylic acid ethyl ester
Formula:
C11H9BrO2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 285.16 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 283.95066 g/mol |
| Monoisotopic Mass | 283.95066 g/mol |
| Topological Polar Surface Area | 54.5 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 247 |
| 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 |