91397-35-2
Product Name:
N-[2-(3-METHYL-4-NITRO-5-ISOXAZOLYL)VINYL]-N-PHENYLAMINE
Formula:
C12H11N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 245.23 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 245.08004122 g/mol |
| Monoisotopic Mass | 245.08004122 g/mol |
| Topological Polar Surface Area | 83.9 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 310 |
| 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 |