7332-32-3
Product Name:
Thiophosphoric acid S-[(4-chlorophenyl)thiomethyl]O,O-dimethyl ester
Formula:
C9H12ClO3PS2
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CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 2074.7 2087 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 298.7 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 297.9654013 g/mol |
| Monoisotopic Mass | 297.9654013 g/mol |
| Topological Polar Surface Area | 86.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 239 |
| 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 |