CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Melting Point | 150.5 °C |
| Solubility | 1980 mg/L (at 25 °C) |
| LogP | 1.15 |
| LogS | -2.23 |
| Dissociation Constants | 8.01 (at 25 °C) |
| Kovats Retention Index | 1417 1417 1417 1421 1412 1420 1425 |
COMPUTED DESCRIPTORS
| Molecular Weight | 198.22 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 198.10044231 g/mol |
| Monoisotopic Mass | 198.10044231 g/mol |
| Topological Polar Surface Area | 66.5 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 294 |
| 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
Metharbital is an organic molecular entity.