921771-98-4
Product Name:
Benzene, 1-chloro-2-[(1S,2S)-2-nitro-1-(nitromethyl)butyl]-
Formula:
C11H13ClN2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 272.68 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 272.0563846 g/mol |
| Monoisotopic Mass | 272.0563846 g/mol |
| Topological Polar Surface Area | 91.6 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 302 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |