EINECS 228-727-0
TL;DR: EINECS 228-727-0 (CAS 6338-12-1) is a chemical compound with molecular formula C14H7N2NaO14S2 and molecular weight 513.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;1,8-dihydroxy-4,5-dinitro-9,10-dioxoanthracene-2,7-disulfonic acid;hydride
Also Known As: EINECS 228-727-0, Disodium 9,10-dihydro-1,8-dihydroxy-4,5-dinitro-9,10-dioxoanthracene-2,7-disulphonate
| Molecular Formula | C14H7N2NaO14S2 |
|---|---|
| Molecular Weight | 513.92 g/mol |
| LogP | -2.7005 |
| Topological Polar Surface Area | 269.62 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 513.92365 |
| Heavy Atoms | 33 |
| Complexity | 1422.8527 |
Chemical Identifiers
| CAS Number | 6338-12-1 |
|---|---|
| SMILES | [H-].C1=C(C2=C(C(=C1S(=O)(=O)O)O)C(=O)C3=C(C2=O)C(=CC(=C3O)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-].[Na+] |
Product Overview
EINECS 228-727-0 (CAS 6338-12-1), with molecular formula C14H7N2NaO14S2 and molecular weight 513.92 g/mol. IUPAC: sodium;1,8-dihydroxy-4,5-dinitro-9,10-dioxoanthracene-2,7-disulfonic acid;hydride.
Chemical Property Profile of EINECS 228-727-0
Property Insights of EINECS 228-727-0
The XLogP value of -2.7005 indicates that EINECS 228-727-0 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 269.62 Ų indicates high polarity, suggesting EINECS 228-727-0 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 228-727-0 has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 228-727-0?
The CAS number of EINECS 228-727-0 is 6338-12-1.
What is the molecular formula of EINECS 228-727-0?
The molecular formula of EINECS 228-727-0 is C14H7N2NaO14S2.
What is the molecular weight of EINECS 228-727-0?
The molecular weight of EINECS 228-727-0 is 513.92 g/mol.
Where can I buy EINECS 228-727-0?
You can request a quote for EINECS 228-727-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 228-727-0?
Yes, KEHONG BIO provides custom synthesis services for EINECS 228-727-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.