CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Color/Form | Crystals from methanol |
| Melting Point | 231-232 °C |
| Solubility | Sparingly soluble in water |
| LogP | 2.4 |
| Stability/Shelf Life | Stable under recommended storage conditions. /Ondansetron hydrochloride dihydrate/ |
| Collision Cross Section | 171.7 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)] |
| Other Experimental Properties | White crystalline solid from water/isopropanol. MP: 178.5-179.5 °C. pKa 7.4 /Ondanestron hydrochloride dihydrate/ |
COMPUTED DESCRIPTORS
| Molecular Weight | 293.4 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 293.152812238 g/mol |
| Monoisotopic Mass | 293.152812238 g/mol |
| Topological Polar Surface Area | 39.8 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 440 |
| 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 |
PRODUCT INTRODUCTION
description
Ondansetron is a member of carbazoles.