CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | White solid or colorless liquid; mp = 22.5 deg C; [GFS Chemicals MSDS] Melting point = 27 deg C; [ChemSampCo MSDS] |
|---|---|
| Kovats Retention Index | 1238 |
| Chemical Classes | Other Classes -> Aliphatics, Unsaturated |
COMPUTED DESCRIPTORS
| Molecular Weight | 250.5 g/mol |
|---|---|
| XLogP3 | 8.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 14 |
| Exact Mass | 250.266051085 g/mol |
| Monoisotopic Mass | 250.266051085 g/mol |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 184 |
| 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
1-Octadecyne is a natural product found in Lonicera japonica with data available.