EINECS 268-674-0
TL;DR: EINECS 268-674-0 (CAS 68133-31-3) is a chemical compound with molecular formula C15H11Cl2N3Na2O5S and molecular weight 460.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-[[(2,4-dichlorophenyl)diazenyl]-ethylamino]-5-sulfonatobenzoate
Also Known As: Benzoic acid, 2-[3-(2,4-dichlorophenyl)-1-ethyl-2-triazenyl]-5-sulfo-, disodium salt, Disodium 2-(3-(2,4-dichlorophenyl)-1-ethyltriazen-2-yl)-5-sulphonatobenzoate, disodium 2-[(2e)-3-(2,4-dichlorophenyl)-1-ethyltriaz-2-en-1-yl]-5-sulfonatobenzoate, disodium 2-[[(2,4-dichlorophenyl)diazenyl]-ethylamino]-5-sulfonatobenzoate, 2,4-Dichloro-1-(N-ethyl-N-(2-carboxy-4-sulfo)phenyl)triazeno)benzene, disodium salt
| Molecular Formula | C15H11Cl2N3Na2O5S |
|---|---|
| Molecular Weight | 460.96 g/mol |
| LogP | -3.21 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.9592 |
| Heavy Atoms | 28 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 68133-31-3 |
|---|---|
| SMILES | CCN(C1=C(C=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])N=NC2=C(C=C(C=C2)Cl)Cl.[Na+].[Na+] |
| InChIKey | IWFWZZWWQUWJSL-UHFFFAOYSA-L |
Product Overview
EINECS 268-674-0 (CAS 68133-31-3), with molecular formula C15H11Cl2N3Na2O5S and molecular weight 460.96 g/mol. IUPAC: disodium;2-[[(2,4-dichlorophenyl)diazenyl]-ethylamino]-5-sulfonatobenzoate.
Chemical Property Profile of EINECS 268-674-0
Property Insights of EINECS 268-674-0
The XLogP value of -3.21 indicates that EINECS 268-674-0 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 268-674-0. Following Lipinski's Rule of Five, EINECS 268-674-0 has 0 hydrogen bond donor(s) and 8 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 EINECS 268-674-0?
The CAS number of EINECS 268-674-0 is 68133-31-3.
What is the molecular formula of EINECS 268-674-0?
The molecular formula of EINECS 268-674-0 is C15H11Cl2N3Na2O5S.
What is the molecular weight of EINECS 268-674-0?
The molecular weight of EINECS 268-674-0 is 460.96 g/mol.
Where can I buy EINECS 268-674-0?
You can request a quote for EINECS 268-674-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 268-674-0?
Yes, KEHONG BIO provides custom synthesis services for EINECS 268-674-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.