CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1483 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 172.22 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 172.109944368 g/mol |
| Monoisotopic Mass | 172.109944368 g/mol |
| Topological Polar Surface Area | 54.4 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 132 |
| 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
9-oxononanoic acid is a medium-chain oxo-fatty acid that is the 9-oxo derivative of nonanoic acid. It has a role as an EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor. It is an aldehydic acid, an omega-oxo fatty acid and a medium-chain fatty acid. It is functionally related to a nonanoic acid. It is a conjugate acid of a 9-oxononanoate.