CHEMICAL AND PHYSICAL PROPERTIES
| Boiling Point | 120-125 |
|---|---|
| Melting Point | 78-82 |
| Collision Cross Section | 163.5 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)] |
| Kovats Retention Index | 1885.4 1888 |
COMPUTED DESCRIPTORS
| Molecular Weight | 263.35 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 263.16854249 g/mol |
| Monoisotopic Mass | 263.16854249 g/mol |
| Topological Polar Surface Area | 20.3 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 279 |
| 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 |
PRODUCT INTRODUCTION
description
1-(4-fluorophenyl)-4-(4-methyl-1-piperidinyl)-1-butanone is an aromatic ketone.