EINECS 270-046-6
TL;DR: EINECS 270-046-6 (CAS 68400-56-6) is a chemical compound with molecular formula C38H22N7Na3O13S3 and molecular weight 949.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;(3Z)-3-[[4-[[4-[[4-(oxaloamino)phenyl]diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]-6-sulfonatonaphthalen-1-yl]hydrazinylidene]-4-oxonaphthalene-1-sulfonate
Also Known As: EINECS 270-046-6, 1-Naphthalenesulfonic acid, 3-((4-((4-((4-N-carboxycarbonylaminophenyl)azo)-6-sulfo-1-naphthalenyl)azo)-6-sulfo-1-naphthalenyl)azo)-4-hydroxy-, trisodium salt, Acetic acid, ((4-((4-((4-((1-hydroxy-4-sulfo-2-naphthalenyl)azo)-7-sulfo-1-naphthalenyl)azo)-7-sulfo-1-naphthalenyl)azo)phenyl)amino)oxo-, trisodium salt, Acetic acid, [[4-[[4-[[4-[(1-hydroxy-4-sulfo-2-naphthalenyl)azo]-7-sulfo-1-naphthalenyl]azo]-7-sulfo-1-naphthalenyl]azo]phenyl]amino]oxo-, trisodium salt, Acetic acid, 2-((4-(2-(4-(2-(4-(2-(1-hydroxy-4-sulfo-2-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)phenyl)amino)-2-oxo-, sodium salt (1:3)
| Molecular Formula | C38H22N7Na3O13S3 |
|---|---|
| Molecular Weight | 949.01 g/mol |
| LogP | -2.7824 |
| Topological Polar Surface Area | 328.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 949.01306 |
| Heavy Atoms | 64 |
| Complexity | 3368.3318 |
Chemical Identifiers
| CAS Number | 68400-56-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C/C(=N/NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=CC=C(C=C7)NC(=O)C(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
Product Overview
EINECS 270-046-6 (CAS 68400-56-6), with molecular formula C38H22N7Na3O13S3 and molecular weight 949.01 g/mol. IUPAC: trisodium;(3Z)-3-[[4-[[4-[[4-(oxaloamino)phenyl]diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]-6-sulfonatonaphthalen-1-yl]hydrazinylidene]-4-oxonaphthalene-1-sulfonate.
Chemical Property Profile of EINECS 270-046-6
Property Insights of EINECS 270-046-6
The XLogP value of -2.7824 indicates that EINECS 270-046-6 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 328.9 Ų indicates high polarity, suggesting EINECS 270-046-6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 270-046-6 has 3 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 270-046-6?
The CAS number of EINECS 270-046-6 is 68400-56-6.
What is the molecular formula of EINECS 270-046-6?
The molecular formula of EINECS 270-046-6 is C38H22N7Na3O13S3.
What is the molecular weight of EINECS 270-046-6?
The molecular weight of EINECS 270-046-6 is 949.01 g/mol.
Where can I buy EINECS 270-046-6?
You can request a quote for EINECS 270-046-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 270-046-6?
Yes, KEHONG BIO provides custom synthesis services for EINECS 270-046-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.