205644-06-0
Product Name:
2-[(5-BROMO-2-THIENYL)CARBONYL]BENZENECARBOXYLIC ACID
Formula:
C12H7BrO3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 311.15 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 309.92993 g/mol |
| Monoisotopic Mass | 309.92993 g/mol |
| Topological Polar Surface Area | 82.6 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 321 |
| 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 |