EINECS 302-166-2
TL;DR: EINECS 302-166-2 (CAS 94094-64-1) is a chemical compound with molecular formula C20H10Na2O11S2 and molecular weight 535.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;1,4-dihydroxy-9,10-dioxo-3-(4-sulfonatophenoxy)anthracene-2-sulfonate
Also Known As: EINECS 302-166-2, Disodium 9,10-dihydro-1,4-dihydroxy-9,10-dioxo-3-(4-sulphonatophenoxy)anthracene-2-sulphonate, DISODIUM 9,10-DIHYDRO-1,4-DIHYDROXY-9,10-DIOXO-3-(4-SULFONATOPHENOXY)ANTHRACENE-2-SULFONATE, disodium9,10-dihydro-1,4-dihydroxy-9,10-dioxo-3- anthracene-2-sulphonate, disodium 1,4-dihydroxy-9,10-dioxo-3-(4-sulfonatophenoxy)anthracene-2-sulfonate
| Molecular Formula | C20H10Na2O11S2 |
|---|---|
| Molecular Weight | 535.95 g/mol |
| LogP | -4.5183 |
| Topological Polar Surface Area | 198.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 535.946 |
| Heavy Atoms | 35 |
| Complexity | 1580.2325 |
Chemical Identifiers
| CAS Number | 94094-64-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C(=C3O)OC4=CC=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+] |
Product Overview
EINECS 302-166-2 (CAS 94094-64-1), with molecular formula C20H10Na2O11S2 and molecular weight 535.95 g/mol. IUPAC: disodium;1,4-dihydroxy-9,10-dioxo-3-(4-sulfonatophenoxy)anthracene-2-sulfonate.
Chemical Property Profile of EINECS 302-166-2
Property Insights of EINECS 302-166-2
The XLogP value of -4.5183 indicates that EINECS 302-166-2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 198.23 Ų indicates high polarity, suggesting EINECS 302-166-2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 302-166-2 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 302-166-2?
The CAS number of EINECS 302-166-2 is 94094-64-1.
What is the molecular formula of EINECS 302-166-2?
The molecular formula of EINECS 302-166-2 is C20H10Na2O11S2.
What is the molecular weight of EINECS 302-166-2?
The molecular weight of EINECS 302-166-2 is 535.95 g/mol.
Where can I buy EINECS 302-166-2?
You can request a quote for EINECS 302-166-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 302-166-2?
Yes, KEHONG BIO provides custom synthesis services for EINECS 302-166-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.