CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1836.9 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 199.28 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 199.07793322 g/mol |
| Monoisotopic Mass | 199.07793322 g/mol |
| Topological Polar Surface Area | 79.1 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 288 |
| 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
1,2,4-Triazin-5(2H)-one, 6-(1,1-dimethylethyl)-3-(methylthio)- is an aryl sulfide.