2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione
TL;DR: 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione (CAS 67122-25-2) is a chemical compound with molecular formula C18H14Br2O4 and molecular weight 451.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione
Also Known As: 2,3-bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione, 1,4-dimethoxy-2,3-dibromomethylanthracene-9,10-dione, 9,10-Anthracenedione,2,3-bis(bromomethyl)-1,4-dimethoxy-, RefChem:244357
| Molecular Formula | C18H14Br2O4 |
|---|---|
| Molecular Weight | 451.93 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.92587 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 67122-25-2 |
|---|---|
| SMILES | COC1=C2C(=C(C(=C1CBr)CBr)OC)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | DFWWTQSJYNWQPT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione (CAS 67122-25-2), with molecular formula C18H14Br2O4 and molecular weight 451.93 g/mol. IUPAC: 2,3-bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione.
Chemical Property Profile of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione
Property Insights of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione
The XLogP value of 3.9 indicates that 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione has 0 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-dimethoxyanthracene-9,10-dione?
The CAS number of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione is 67122-25-2.
What is the molecular formula of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione?
The molecular formula of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione is C18H14Br2O4.
What is the molecular weight of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione?
The molecular weight of 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione is 451.93 g/mol.
Where can I buy 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione?
You can request a quote for 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-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-dimethoxyanthracene-9,10-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Bis(bromomethyl)-1,4-dimethoxyanthracene-9,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.