Einecs 273-438-5
TL;DR: Einecs 273-438-5 (CAS 68966-49-4) is a chemical compound with molecular formula C41H43N7O17S4 and molecular weight 1033.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-2-methoxy-5-methylphenyl]carbamoylamino]-5-methoxy-2-methylphenyl]diazenyl]naphthalene-1,5-disulfonic acid;2-(2-hydroxyethylamino)ethanol
Also Known As: Direct Yellow 34 diethanolamine, 1,5-Naphthalenedisulfonic acid, 3,3'-[carbonylbis[imino(5-methoxy-2-methyl-4,1-phenylene)azo]]bis-, compd. with 2,2'-iminobis[ethanol], 1,5-Naphthalenedisulfonic acid, 3,3'-(carbonylbis(imino(5-methoxy-2-methyl-4,1-phenylene)-2,1-diazenediyl))bis-, compd. with 2,2'-iminobis(ethanol) (1:?), 1,5-Naphthalenedisulfonic acid, 3,3'-(carbonylbis(imino(5-methoxy-2-methyl-4,1-phenylene)azo))bis-, compd. with 2,2'-iminobis(ethanol), 1,5-Naphthalenedisulfonic acid, 3,3'-(carbonylbis(imino(5-methoxy-2-methyl-4,1-phenylene)azo))bis-, diethanolamine salt
| Molecular Formula | C41H43N7O17S4 |
|---|---|
| Molecular Weight | 1033.16 g/mol |
| LogP | 6.64924 |
| Topological Polar Surface Area | 413.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 16 |
| Exact Mass | 1033.1598 |
| Heavy Atoms | 69 |
| Complexity | 1970.0 |
Chemical Identifiers
| CAS Number | 68966-49-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N=NC2=CC3=C(C=CC=C3S(=O)(=O)O)C(=C2)S(=O)(=O)O)OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC6=C(C=CC=C6S(=O)(=O)O)C(=C5)S(=O)(=O)O)OC.C(CO)NCCO |
| InChIKey | NYZIHEMGFHRHMT-UHFFFAOYSA-N |
Product Overview
Einecs 273-438-5 (CAS 68966-49-4), with molecular formula C41H43N7O17S4 and molecular weight 1033.16 g/mol. IUPAC: 3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-2-methoxy-5-methylphenyl]carbamoylamino]-5-methoxy-2-methylphenyl]diazenyl]naphthalene-1,5-disulfonic acid;2-(2-hydroxyethylamino)ethanol.
Chemical Property Profile of Einecs 273-438-5
Property Insights of Einecs 273-438-5
The XLogP value of 6.64924 indicates that Einecs 273-438-5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 413.0 Ų indicates high polarity, suggesting Einecs 273-438-5 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 273-438-5 has 9 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Einecs 273-438-5?
The CAS number of Einecs 273-438-5 is 68966-49-4.
What is the molecular formula of Einecs 273-438-5?
The molecular formula of Einecs 273-438-5 is C41H43N7O17S4.
What is the molecular weight of Einecs 273-438-5?
The molecular weight of Einecs 273-438-5 is 1033.16 g/mol.
Where can I buy Einecs 273-438-5?
You can request a quote for Einecs 273-438-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 273-438-5?
Yes, KEHONG BIO provides custom synthesis services for Einecs 273-438-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.