1261815-91-1
Product Name:
Benzeneethanamine, 3-(2,4,5-trichloro-2,4-cyclohexadien-1-yl)-4-(trifluoromethyl)-
Formula:
C15H13Cl3F3N
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COMPUTED DESCRIPTORS
| Molecular Weight | 370.6 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 369.006567 g/mol |
| Monoisotopic Mass | 369.006567 g/mol |
| Topological Polar Surface Area | 26 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 473 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |