21243-02-7
Product Name:
5-methoxy-3-methyl-1-benzothiophene-2-carboxylic acid
Formula:
C11H10O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 222.26 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 222.03506535 g/mol |
| Monoisotopic Mass | 222.03506535 g/mol |
| Topological Polar Surface Area | 74.8 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 256 |
| 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 |