CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Light brown crystalline solid; roasted, meaty odour |
|---|---|
| Solubility | Insoluble in water, heptane, triacetin |
| Kovats Retention Index | 1166.9 1168 1150 1194 1202 1181 1181 1174 1204 1211 |
COMPUTED DESCRIPTORS
| Molecular Weight | 163.3 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 163.04894177 g/mol |
| Monoisotopic Mass | 163.04894177 g/mol |
| Topological Polar Surface Area | 62.6 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 87.1 |
| 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
Thialdine is an organonitrogen heterocyclic compound, an organosulfur heterocyclic compound and an organic heteromonocyclic compound.