2-Amino-1-bromo-3-chloro-anthraquinone
TL;DR: 2-Amino-1-bromo-3-chloro-anthraquinone (CAS 117267-53-5) is a chemical compound with molecular formula C14H7BrClNO2 and molecular weight 334.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-bromo-3-chloroanthracene-9,10-dione
Also Known As: 2-amino-1-bromo-3-chloroanthracene-9,10-dione, 2-Amino-1-bromo-3-chloro-anthraquinone, 2-Amino-1-bromo-3-chloroanthraquinone, 9, 2-amino-1-bromo-3-chloro-, 1-Bromo-3-chloro-2-aminoanthraquinone
| Molecular Formula | C14H7BrClNO2 |
|---|---|
| Molecular Weight | 334.93 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 334.93488 |
| Heavy Atoms | 19 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 117267-53-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)Br)N)Cl |
| InChIKey | ZFWJIKSKKWACEX-UHFFFAOYSA-N |
Product Overview
2-Amino-1-bromo-3-chloro-anthraquinone (CAS 117267-53-5), with molecular formula C14H7BrClNO2 and molecular weight 334.93 g/mol. IUPAC: 2-amino-1-bromo-3-chloroanthracene-9,10-dione.
Chemical Property Profile of 2-Amino-1-bromo-3-chloro-anthraquinone
Property Insights of 2-Amino-1-bromo-3-chloro-anthraquinone
The XLogP value of 3.5 indicates that 2-Amino-1-bromo-3-chloro-anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1-bromo-3-chloro-anthraquinone. Following Lipinski's Rule of Five, 2-Amino-1-bromo-3-chloro-anthraquinone has 1 hydrogen bond donor(s) and 3 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-Amino-1-bromo-3-chloro-anthraquinone?
The CAS number of 2-Amino-1-bromo-3-chloro-anthraquinone is 117267-53-5.
What is the molecular formula of 2-Amino-1-bromo-3-chloro-anthraquinone?
The molecular formula of 2-Amino-1-bromo-3-chloro-anthraquinone is C14H7BrClNO2.
What is the molecular weight of 2-Amino-1-bromo-3-chloro-anthraquinone?
The molecular weight of 2-Amino-1-bromo-3-chloro-anthraquinone is 334.93 g/mol.
Where can I buy 2-Amino-1-bromo-3-chloro-anthraquinone?
You can request a quote for 2-Amino-1-bromo-3-chloro-anthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-1-bromo-3-chloro-anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-1-bromo-3-chloro-anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.