CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Clear colorless liquid; [Sigma-Aldrich MSDS] |
|---|---|
| Color/Form | Clear, colorless liquid |
| Boiling Point | BP: 69-71 °C at 0.001 mm Hg |
| Density | 282.55 |
| Stability/Shelf Life | Stable under recommended storage conditions. |
| Kovats Retention Index | 1816 1811 1812 1814 1811 1814 1814 1815 1812 1816 1811 1812 1813 |
| Chemical Classes | Other Classes -> Aliphatics, Saturated (>C11) |
COMPUTED DESCRIPTORS
| Molecular Weight | 282.5 g/mol |
|---|---|
| XLogP3 | 9.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 13 |
| Exact Mass | 282.328651340 g/mol |
| Monoisotopic Mass | 282.328651340 g/mol |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 194 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Phytane is a diterpene.