Levafix orange E 3GA
TL;DR: Levafix orange E 3GA (CAS 61901-80-2) is a chemical compound with molecular formula C24H11ClF2N5Na3O10S3 and molecular weight 766.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;2-[[6-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,5-disulfonate
Also Known As: Levafix orange E 3GA, C.I. Reactive Orange 64, 1,5-Naphthalenedisulfonic acid, 2-(2-(6-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:3), 2-((6-((5-Chloro-2,6-difluoro-4-pyrimidinyl)amino)-1-hydroxy-3-sulpho-2-naphthyl)azo)naphthalene-1,5-disulphonic acid, sodium salt, 1,5-Naphthalenedisulfonic acid, 2-((6-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)azo)-, trisodium salt
| Molecular Formula | C24H11ClF2N5Na3O10S3 |
|---|---|
| Molecular Weight | 766.90 g/mol |
| LogP | -4.6965 |
| Topological Polar Surface Area | 280.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 4 |
| Exact Mass | 766.9018 |
| Heavy Atoms | 48 |
| Complexity | 1390.0 |
Chemical Identifiers
| CAS Number | 61901-80-2 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N=NC3=C(C=C4C=C(C=CC4=C3O)NC5=C(C(=NC(=N5)F)F)Cl)S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | XAQCRMBBLVHCHU-UHFFFAOYSA-K |
Product Overview
Levafix orange E 3GA (CAS 61901-80-2), with molecular formula C24H11ClF2N5Na3O10S3 and molecular weight 766.90 g/mol. IUPAC: trisodium;2-[[6-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,5-disulfonate.
Chemical Property Profile of Levafix orange E 3GA
Property Insights of Levafix orange E 3GA
The XLogP value of -4.6965 indicates that Levafix orange E 3GA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 280.0 Ų indicates high polarity, suggesting Levafix orange E 3GA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Levafix orange E 3GA has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Levafix orange E 3GA?
The CAS number of Levafix orange E 3GA is 61901-80-2.
What is the molecular formula of Levafix orange E 3GA?
The molecular formula of Levafix orange E 3GA is C24H11ClF2N5Na3O10S3.
What is the molecular weight of Levafix orange E 3GA?
The molecular weight of Levafix orange E 3GA is 766.90 g/mol.
Where can I buy Levafix orange E 3GA?
You can request a quote for Levafix orange E 3GA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Levafix orange E 3GA?
Yes, KEHONG BIO provides custom synthesis services for Levafix orange E 3GA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.