CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 174.9 Ų [M-H]- |
|---|---|
| Chemical Classes | other linear non-peptide (Polybrominated diphenyl ethers (PBDEs)) |
COMPUTED DESCRIPTORS
| Molecular Weight | 501.79 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 501.70603 g/mol |
| Monoisotopic Mass | 497.71013 g/mol |
| Topological Polar Surface Area | 29.5 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 279 |
| 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
3,5-Dibromo-2-(2,4-dibromophenoxy)phenol is a natural product found in Dysidea and Lamellodysidea herbacea with data available.