871909-88-5
Product Name:
Benzene, 1-chloro-2-isothiocyanato-3,5-dimethyl-
Formula:
C9H8ClNS
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COMPUTED DESCRIPTORS
| Molecular Weight | 197.69 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 197.0065981 g/mol |
| Monoisotopic Mass | 197.0065981 g/mol |
| Topological Polar Surface Area | 44.4 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 201 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |