845879-16-5
Product Name:
1-CYANO-2-(5,5-DICHLORO-2-METHYLPENTA-2,4-DIENYL)-3-METHYLISOTHIOUREA
Formula:
C9H11Cl2N3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 264.17 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 263.0050739 g/mol |
| Monoisotopic Mass | 263.0050739 g/mol |
| Topological Polar Surface Area | 73.5 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 335 |
| 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 |