663884-63-7
Product Name:
3-(3,5-bis-trifluoromethyl-phenyl)-propionitrile
Formula:
C11H7F6N
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COMPUTED DESCRIPTORS
| Molecular Weight | 267.17 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 267.04826820 g/mol |
| Monoisotopic Mass | 267.04826820 g/mol |
| Topological Polar Surface Area | 23.8 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 301 |
| 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 |