CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid; [HSDB] |
|---|---|
| Color/Form | Crystals (from crystallization with dilute alcohol) |
| Boiling Point | 260-265 °C @ 8 mm Hg |
| Melting Point | 79.8 °C |
| Solubility | Sol in ether, benzene; slightly soluble in ethanol |
| Density | 1.197 @ 25 °C |
| Vapor Pressure | 0.00000003 [mmHg] |
| Other Experimental Properties | log Kow= 5.63 /Kronitex TXP/ |
| Chemical Classes | Other Classes -> Organophosphates, Other |
COMPUTED DESCRIPTORS
| Molecular Weight | 410.4 g/mol |
|---|---|
| XLogP3 | 7.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 410.16469634 g/mol |
| Monoisotopic Mass | 410.16469634 g/mol |
| Topological Polar Surface Area | 44.8 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 491 |
| 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 |