303995-66-6
Product Name:
4-(4-[2-(3-METHYL-4-NITRO-5-ISOXAZOLYL)VINYL]PHENYL)-3-BUTEN-2-ONE
Formula:
C16H14N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 298.29 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 298.09535693 g/mol |
| Monoisotopic Mass | 298.09535693 g/mol |
| Topological Polar Surface Area | 88.9 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 461 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |