A0553/0025568
TL;DR: A0553/0025568 (CAS 339240-67-4) is a chemical compound with molecular formula C19H12F11NO2 and molecular weight 495.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(2,2,3,3,4,4,5,5-octafluoropentoxy)-5-(trifluoromethyl)phenyl]iminomethyl]phenol
Also Known As: A0553/0025568, 2-[(E)-({2-[(2,2,3,3,4,4,5,5-octafluoropentyl)oxy]-5-(trifluoromethyl)phenyl}imino)methyl]phenol, 2-[5-Trifluoromethyl-2-(2,2,3,3,4,4,5,5-octafluoropentoxy)phenyliminomethyl]phenol, Phenol, 2-[5-trifluoromethyl-2-(2,2,3,3,4,4,5,5-octafluoropentoxy)phenyliminomethyl]-, (6E)-6-[[2-(2,2,3,3,4,4,5,5-octafluoropentoxy)-5-(trifluoromethyl)anilino]methylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C19H12F11NO2 |
|---|---|
| Molecular Weight | 495.07 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 495.06924 |
| Heavy Atoms | 33 |
| Complexity | 669.0 |
Chemical Identifiers
| CAS Number | 339240-67-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NC2=C(C=CC(=C2)C(F)(F)F)OCC(C(C(C(F)F)(F)F)(F)F)(F)F)O |
| InChIKey | BQPOXEQQFKSDQV-UHFFFAOYSA-N |
Product Overview
A0553/0025568 (CAS 339240-67-4), with molecular formula C19H12F11NO2 and molecular weight 495.07 g/mol. IUPAC: 2-[[2-(2,2,3,3,4,4,5,5-octafluoropentoxy)-5-(trifluoromethyl)phenyl]iminomethyl]phenol.
Chemical Property Profile of A0553/0025568
Property Insights of A0553/0025568
The XLogP value of 6.6 indicates that A0553/0025568 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.8 Ų, A0553/0025568 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A0553/0025568 has 1 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A0553/0025568?
The CAS number of A0553/0025568 is 339240-67-4.
What is the molecular formula of A0553/0025568?
The molecular formula of A0553/0025568 is C19H12F11NO2.
What is the molecular weight of A0553/0025568?
The molecular weight of A0553/0025568 is 495.07 g/mol.
Where can I buy A0553/0025568?
You can request a quote for A0553/0025568 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0553/0025568?
Yes, KEHONG BIO provides custom synthesis services for A0553/0025568 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.