CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Orange solid; [Merck Index] Orange odorless powder; [Alfa Aesar MSDS] |
|---|---|
| Melting Point | 203 dec °C |
| Vapor Pressure | 0.0000111 [mmHg] |
| LogP | 0.83 |
| Kovats Retention Index | 1712 1712 |
| Chemical Classes | Nitrogen Compounds -> Indoles |
COMPUTED DESCRIPTORS
| Molecular Weight | 147.13 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 147.032028402 g/mol |
| Monoisotopic Mass | 147.032028402 g/mol |
| Topological Polar Surface Area | 46.2 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 212 |
| 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
Isatin is an indoledione that is the 2,3-diketo derivative of indole. It has a role as an EC 1.4.3.4 (monoamine oxidase) inhibitor and a plant metabolite.