22595-52-4
Product Name:
2-(1-Oxo-2-methylpropyl)-4,6,6-trimethyl-5-methoxy-4-cyclohexene-1,3-dione
Formula:
C14H20O4
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1698 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 252.31 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 252.13615911 g/mol |
| Monoisotopic Mass | 252.13615911 g/mol |
| Topological Polar Surface Area | 60.4 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 441 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Tasmanone is a natural product found in Baeckea frutescens, Eucalyptus cloeziana, and other organisms with data available.