Einecs 286-385-8
TL;DR: Einecs 286-385-8 (CAS 85223-30-9) is a chemical compound with molecular formula C46H29N7Na4O16S4 and molecular weight 1155.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrasodium;5-benzamido-3-[[4-[4-[(8-benzamido-1-hydroxy-3,6-disulfonatonaphthalen-2-yl)diazenyl]anilino]phenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonate
Also Known As: 2,7-Naphthalenedisulfonic acid, 3,3'-(iminobis(4,1-phenylene-2,1-diazenediyl))bis(5-(benzoylamino)-4-hydroxy-, sodium salt (1:?), 2,7-Naphthalenedisulfonic acid, 3,3'-(iminobis(4,1-phenyleneazo))bis(5-(benzoylamino)-4-hydroxy-, sodium salt, Disodium 3,3'-(iminobis(4,1-phenyleneazo))bis(5-(benzoylamino)-4-hydroxynaphthalene-2,7-disulphonate), EINECS 286-385-8
| Molecular Formula | C46H29N7Na4O16S4 |
|---|---|
| Molecular Weight | 1155.01 g/mol |
| LogP | -3.8844 |
| Topological Polar Surface Area | 422.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 10 |
| Exact Mass | 1155.0144 |
| Heavy Atoms | 77 |
| Complexity | 2220.0 |
Chemical Identifiers
| CAS Number | 85223-30-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3O)N=NC4=CC=C(C=C4)NC5=CC=C(C=C5)N=NC6=C(C7=C(C=C(C=C7C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C8=CC=CC=C8)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
| InChIKey | MCPWQISAUYGWPL-UHFFFAOYSA-J |
Product Overview
Einecs 286-385-8 (CAS 85223-30-9), with molecular formula C46H29N7Na4O16S4 and molecular weight 1155.01 g/mol. IUPAC: tetrasodium;5-benzamido-3-[[4-[4-[(8-benzamido-1-hydroxy-3,6-disulfonatonaphthalen-2-yl)diazenyl]anilino]phenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonate.
Chemical Property Profile of Einecs 286-385-8
Property Insights of Einecs 286-385-8
The XLogP value of -3.8844 indicates that Einecs 286-385-8 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 422.0 Ų indicates high polarity, suggesting Einecs 286-385-8 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 286-385-8 has 5 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 286-385-8?
The CAS number of Einecs 286-385-8 is 85223-30-9.
What is the molecular formula of Einecs 286-385-8?
The molecular formula of Einecs 286-385-8 is C46H29N7Na4O16S4.
What is the molecular weight of Einecs 286-385-8?
The molecular weight of Einecs 286-385-8 is 1155.01 g/mol.
Where can I buy Einecs 286-385-8?
You can request a quote for Einecs 286-385-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 286-385-8?
Yes, KEHONG BIO provides custom synthesis services for Einecs 286-385-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.