CHEMICAL AND PHYSICAL PROPERTIES
| Optical Rotation | Crystals, decomposes at 254 °C. Specific optical rotation = +34 deg at 20 °C/D (c = 2 in methanol). /Hydrochloride/ |
|---|---|
| Kovats Retention Index | 2323 2340 2340 |
| Other Experimental Properties | Oily liquid /Dioxadrol/ |
COMPUTED DESCRIPTORS
| Molecular Weight | 309.4 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 309.172878976 g/mol |
| Monoisotopic Mass | 309.172878976 g/mol |
| Topological Polar Surface Area | 30.5 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 356 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Dioxadrol is a diarylmethane.