2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione
TL;DR: 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione (CAS 77422-59-4) is a chemical compound with molecular formula C16H10Br2O4 and molecular weight 423.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione
Also Known As: 2,3-bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione, 9, 2,3-bis(bromomethyl)-1,4-dihydroxy-, 2,3-Bis(bromomethyl)-1,4-dihydroxyanthraquinone, 2,3-bis(bromomethyl)-1,4-dihydroxyanthra-9,10-quinone, 2,3-bis(bromomethyl)-1,4-dihydroxy-anthracene-9,10-dione
| Molecular Formula | C16H10Br2O4 |
|---|---|
| Molecular Weight | 423.89 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 423.8946 |
| Heavy Atoms | 22 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 77422-59-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C(=C(C(=C3C2=O)O)CBr)CBr)O |
| InChIKey | PKHIPHBPAMPVCE-UHFFFAOYSA-N |
Product Overview
2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione (CAS 77422-59-4), with molecular formula C16H10Br2O4 and molecular weight 423.89 g/mol. IUPAC: 2,3-bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione.
Chemical Property Profile of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione
Property Insights of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione
The XLogP value of 4.4 indicates that 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione. Following Lipinski's Rule of Five, 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione?
The CAS number of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione is 77422-59-4.
What is the molecular formula of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione?
The molecular formula of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione is C16H10Br2O4.
What is the molecular weight of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione?
The molecular weight of 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione is 423.89 g/mol.
Where can I buy 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione?
You can request a quote for 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Bis(bromomethyl)-1,4-dihydroxyanthracene-9,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.