C.I. Fluorescent Brightener 9
TL;DR: C.I. Fluorescent Brightener 9 (CAS 133-66-4) is a chemical compound with molecular formula C44H34N12Na2O6S2 and molecular weight 936.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;5-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]-2-[2-[4-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate
Also Known As: C.I. Fluorescent Brightener 9, Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis[5-[[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]amino]-, disodium salt, disodium;5-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]-2-[2-[4-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate, Benzenesulfonic acid,2,2'-(1,2-ethenediyl)bis[5-[[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]amino]-,sodium salt (1:2), Disodium 2,2'-(ethene-1,2-diyl)bis{5-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]benzene-1-sulfonate}
| Molecular Formula | C44H34N12Na2O6S2 |
|---|---|
| Molecular Weight | 936.20 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 281.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 14 |
| Exact Mass | 936.1961 |
| Heavy Atoms | 66 |
| Complexity | 1460.0 |
Chemical Identifiers
| CAS Number | 133-66-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)NC7=CC=CC=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])NC8=CC=CC=C8.[Na+].[Na+] |
| InChIKey | HOSFCSQXJQXSIQ-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
C.I. Fluorescent Brightener 9 (CAS 133-66-4), with molecular formula C44H34N12Na2O6S2 and molecular weight 936.20 g/mol. IUPAC: disodium;5-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]-2-[2-[4-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate.
Chemical Property Profile of C.I. Fluorescent Brightener 9
Property Insights of C.I. Fluorescent Brightener 9
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C.I. Fluorescent Brightener 9. The TPSA of 281.0 Ų indicates high polarity, suggesting C.I. Fluorescent Brightener 9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C.I. Fluorescent Brightener 9 has 6 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 C.I. Fluorescent Brightener 9?
The CAS number of C.I. Fluorescent Brightener 9 is 133-66-4.
What is the molecular formula of C.I. Fluorescent Brightener 9?
The molecular formula of C.I. Fluorescent Brightener 9 is C44H34N12Na2O6S2.
What is the molecular weight of C.I. Fluorescent Brightener 9?
The molecular weight of C.I. Fluorescent Brightener 9 is 936.20 g/mol.
Where can I buy C.I. Fluorescent Brightener 9?
You can request a quote for C.I. Fluorescent Brightener 9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C.I. Fluorescent Brightener 9?
Yes, KEHONG BIO provides custom synthesis services for C.I. Fluorescent Brightener 9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.