860788-50-7
Product Name:
(E)-1-(5-CHLORO-2-THIENYL)-3-(DIMETHYLAMINO)-2-BUTEN-1-ONE
Formula:
C10H12ClNOS
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >34.5 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 229.73 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 229.0328129 g/mol |
| Monoisotopic Mass | 229.0328129 g/mol |
| Topological Polar Surface Area | 48.6 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 253 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |