477852-20-3
Product Name:
3-NITRO-4-([3-(TRIFLUOROMETHYL)PHENYL]SULFANYL)BENZENECARBALDEHYDE O-(3,4-DICHLOROBENZYL)OXIME
Formula:
C21H13Cl2F3N2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 501.3 g/mol |
|---|---|
| XLogP3 | 7.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 499.9976033 g/mol |
| Monoisotopic Mass | 499.9976033 g/mol |
| Topological Polar Surface Area | 92.7 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 653 |
| 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 |