Einecs 259-779-2
TL;DR: Einecs 259-779-2 (CAS 55728-51-3) is a chemical compound with molecular formula C20H11Br2HgO6 and molecular weight 706.86285 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2',7'-dibromo-3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-1'-yl)mercury;hydrate
Also Known As: (2',7'-Dibromo-3',6'-dihydroxy-3-oxospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-4'-yl)hydroxymercury, Mercury, (2',7'-dibromo-3',6'-dihydroxy-3-oxospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-4'-yl)hydroxy-, EINECS 259-779-2
Technical Specifications
| Molecular Formula | C20H11Br2HgO6 |
| Molecular Weight | 706.86285 g/mol |
| XLogP | 3.54 |
| Topological Polar Surface Area (TPSA) | 77.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 708.86084 Da |
| Heavy Atoms | 29 |
| Complexity | 654.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=C3C(=C(C(=C5)O)Br)[Hg])O)Br.O |
| InChIKey | NWAOWIDEGDXDGM-UHFFFAOYSA-N |
Chemical Property Profile of Einecs 259-779-2
Property Insights of Einecs 259-779-2
The XLogP value of 3.54 indicates that Einecs 259-779-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 259-779-2. Following Lipinski's Rule of Five, Einecs 259-779-2 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Einecs 259-779-2?
The CAS number of Einecs 259-779-2 is 55728-51-3.
What is the molecular formula of Einecs 259-779-2?
The molecular formula of Einecs 259-779-2 is C20H11Br2HgO6.
What is the molecular weight of Einecs 259-779-2?
The molecular weight of Einecs 259-779-2 is 706.86285 g/mol.
Where can I buy Einecs 259-779-2?
You can request a quote for Einecs 259-779-2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Einecs 259-779-2?
Yes, CoreyChem provides custom synthesis services for Einecs 259-779-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.