339097-03-9
Product Name:
METHYL 3-([4-(DIMETHYLAMINO)-1-METHYL-2-OXO-3-BUTENYL]OXY)-2-THIOPHENECARBOXYLATE
Formula:
C13H17NO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 283.35 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 283.08782920 g/mol |
| Monoisotopic Mass | 283.08782920 g/mol |
| Topological Polar Surface Area | 84.1 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 357 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |