CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 163.1 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)] |
|---|---|
| Kovats Retention Index | 2307.2 |
COMPUTED DESCRIPTORS
| Molecular Weight | 263.4 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 3 |
| Exact Mass | 263.167399674 g/mol |
| Monoisotopic Mass | 263.167399674 g/mol |
| Topological Polar Surface Area | 26 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 326 |
| 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
Demethylmaprotiline is a member of anthracenes.