CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 14.3 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 190.22 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 190.02008399 g/mol |
| Monoisotopic Mass | 190.02008399 g/mol |
| Topological Polar Surface Area | 75.1 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 225 |
| 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
2-(1,3-Benzoxazol-2-ylsulfanyl)acetonitrile is a benzoxazole.