Fluo-3FF (potassium salt)
TL;DR: Fluo-3FF (potassium salt) (CAS 749199-09-5) is a chemical compound with molecular formula C35H26Cl2F2N2O13 and molecular weight 790.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-[6-[bis(carboxymethyl)amino]-2,3-difluorophenoxy]ethoxy]-N-(carboxymethyl)-4-(2,7-dichloro-3-hydroxy-6-oxoxanthen-9-yl)anilino]acetic acid
Also Known As: Fluo-3FF (potassium salt), 2,2'-((2-(2-(6-(bis(carboxymethyl)amino)-2,3-difluorophenoxy)ethoxy)-4-(2,7-dichloro-6-hydroxy-3-oxo-3H-xanthen-9-yl)phenyl)azanediyl)diacetic acid, 2-[2-[2-[6-[bis(carboxymethyl)amino]-2,3-difluorophenoxy]ethoxy]-N-(carboxymethyl)-4-(2,7-dichloro-3-hydroxy-6-oxoxanthen-9-yl)anilino]acetic acid
| Molecular Formula | C35H26Cl2F2N2O13 |
|---|---|
| Molecular Weight | 790.08 g/mol |
| LogP | 5.2644 |
| Topological Polar Surface Area | 224.58 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 16 |
| Exact Mass | 790.078 |
| Heavy Atoms | 54 |
| Complexity | 2303.693 |
Chemical Identifiers
| CAS Number | 749199-09-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)Cl)O)Cl)OCCOC5=C(C=CC(=C5F)F)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O |
Product Overview
Fluo-3FF (potassium salt) (CAS 749199-09-5), with molecular formula C35H26Cl2F2N2O13 and molecular weight 790.08 g/mol. IUPAC: 2-[2-[2-[6-[bis(carboxymethyl)amino]-2,3-difluorophenoxy]ethoxy]-N-(carboxymethyl)-4-(2,7-dichloro-3-hydroxy-6-oxoxanthen-9-yl)anilino]acetic acid.
Chemical Property Profile of Fluo-3FF (potassium salt)
Property Insights of Fluo-3FF (potassium salt)
The XLogP value of 5.2644 indicates that Fluo-3FF (potassium salt) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 224.58 Ų indicates high polarity, suggesting Fluo-3FF (potassium salt) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Fluo-3FF (potassium salt) has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fluo-3FF (potassium salt)?
The CAS number of Fluo-3FF (potassium salt) is 749199-09-5.
What is the molecular formula of Fluo-3FF (potassium salt)?
The molecular formula of Fluo-3FF (potassium salt) is C35H26Cl2F2N2O13.
What is the molecular weight of Fluo-3FF (potassium salt)?
The molecular weight of Fluo-3FF (potassium salt) is 790.08 g/mol.
Where can I buy Fluo-3FF (potassium salt)?
You can request a quote for Fluo-3FF (potassium salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluo-3FF (potassium salt)?
Yes, KEHONG BIO provides custom synthesis services for Fluo-3FF (potassium salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.