RefChem:417529
TL;DR: RefChem:417529 (CAS 68109-92-2) is a chemical compound with molecular formula C14H6BrK2NO8S2 and molecular weight 536.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipotassium;5-amino-8-bromo-9,10-dioxoanthracene-1,6-disulfonate
Also Known As: 1,6-Anthraquinonedisulfonic acid, 5-amino-8-bromo-, dipotassium salt, 1,6-Anthracenedisulfonic acid, 5-amino-8-bromo-9,10-dihydro-9,10-dioxo-, dipotassium salt, dipotassium 5-amino-8-bromo-9,10-dioxo-9,10-dihydroanthracene-1,6-disulfonate, 1,6-Anthracenedisulfonic acid, 5-amino-8-bromo-9,10-dihydro-9,10-dioxo-, potassium salt (1:2), dipotassium 5-amino-8-bromo-9,10-dioxoanthracene-1,6-disulfonate
| Molecular Formula | C14H6BrK2NO8S2 |
|---|---|
| Molecular Weight | 536.80 g/mol |
| LogP | -5.38 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 536.79926 |
| Heavy Atoms | 28 |
| Complexity | 803.0 |
Chemical Identifiers
| CAS Number | 68109-92-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C=C(C(=C3C2=O)N)S(=O)(=O)[O-])Br.[K+].[K+] |
| InChIKey | CCZKCDMJWAJLQU-UHFFFAOYSA-L |
Product Overview
RefChem:417529 (CAS 68109-92-2), with molecular formula C14H6BrK2NO8S2 and molecular weight 536.80 g/mol. IUPAC: dipotassium;5-amino-8-bromo-9,10-dioxoanthracene-1,6-disulfonate.
Chemical Property Profile of RefChem:417529
Property Insights of RefChem:417529
The XLogP value of -5.38 indicates that RefChem:417529 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting RefChem:417529 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:417529 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:417529?
The CAS number of RefChem:417529 is 68109-92-2.
What is the molecular formula of RefChem:417529?
The molecular formula of RefChem:417529 is C14H6BrK2NO8S2.
What is the molecular weight of RefChem:417529?
The molecular weight of RefChem:417529 is 536.80 g/mol.
Where can I buy RefChem:417529?
You can request a quote for RefChem:417529 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:417529?
Yes, KEHONG BIO provides custom synthesis services for RefChem:417529 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.