175202-62-7
Product Name:
4-ACETYL-3-METHYL-5-(METHYLTHIO)THIOPHENE-2-CARBONITRILE
Formula:
C9H9NOS2
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COMPUTED DESCRIPTORS
| Molecular Weight | 211.3 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 211.01255626 g/mol |
| Monoisotopic Mass | 211.01255626 g/mol |
| Topological Polar Surface Area | 94.4 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 258 |
| 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 |