34674-75-4
Product Name:
3-AMino-5-nitro-benzo[b]thiophene-2-carboxylic acid Methyl ester
Formula:
C10H8N2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 252.25 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 252.02047791 g/mol |
| Monoisotopic Mass | 252.02047791 g/mol |
| Topological Polar Surface Area | 126 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 333 |
| 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 |