CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1814 1819 1817.3 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 260.5 g/mol |
|---|---|
| XLogP3 | 8.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 11 |
| Exact Mass | 260.250401021 g/mol |
| Monoisotopic Mass | 260.250401021 g/mol |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 179 |
| 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
Benzene, (1-pentyloctyl)- is a natural product found in Acca sellowiana with data available.