26139-07-1
Product Name:
GAMMA-OXO-ALPHA-METHYL-2-DIBENZOTHIOPHENEBUTYRIC ACID
Formula:
C17H14O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 298.4 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 298.06636548 g/mol |
| Monoisotopic Mass | 298.06636548 g/mol |
| Topological Polar Surface Area | 82.6 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 422 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |