71108-21-9
Product Name:
Propanedinitrile, [4,4-dimethyl-5-[[[[methyl[(trichloromethyl)thio]amino]carbonyl]oxy]imino]-1,3-dithiolan-2-ylidene]- (9CI)
Formula:
C11H9Cl3N4O2S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 431.8 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 429.895322 g/mol |
| Monoisotopic Mass | 429.895322 g/mol |
| Topological Polar Surface Area | 165 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 651 |
| 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 |