3-(Tridecafluoroundecyl)catechol
TL;DR: 3-(Tridecafluoroundecyl)catechol (CAS 131545-70-5) is a chemical compound with molecular formula C17H15F13O2 and molecular weight 498.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoroundecyl)benzene-1,2-diol
Also Known As: 3-Tdfuc, 3-(Tridecafluoroundecyl)catechol, AmbotzFAA1294, 3-(6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoroundecyl)benzene-1,2-diol, 1,2-Benzenediol, 3-(6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoroundecyl)-
| Molecular Formula | C17H15F13O2 |
|---|---|
| Molecular Weight | 498.09 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 498.08646 |
| Heavy Atoms | 32 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 131545-70-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)O)O)CCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | YSINYTWRJZQLMC-UHFFFAOYSA-N |
Product Overview
3-(Tridecafluoroundecyl)catechol (CAS 131545-70-5), with molecular formula C17H15F13O2 and molecular weight 498.09 g/mol. IUPAC: 3-(6,6,7,7,8,8,9,9,10,10,11,11,11-tridecafluoroundecyl)benzene-1,2-diol.
Chemical Property Profile of 3-(Tridecafluoroundecyl)catechol
Property Insights of 3-(Tridecafluoroundecyl)catechol
The XLogP value of 7.7 indicates that 3-(Tridecafluoroundecyl)catechol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3-(Tridecafluoroundecyl)catechol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Tridecafluoroundecyl)catechol has 2 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Tridecafluoroundecyl)catechol?
The CAS number of 3-(Tridecafluoroundecyl)catechol is 131545-70-5.
What is the molecular formula of 3-(Tridecafluoroundecyl)catechol?
The molecular formula of 3-(Tridecafluoroundecyl)catechol is C17H15F13O2.
What is the molecular weight of 3-(Tridecafluoroundecyl)catechol?
The molecular weight of 3-(Tridecafluoroundecyl)catechol is 498.09 g/mol.
Where can I buy 3-(Tridecafluoroundecyl)catechol?
You can request a quote for 3-(Tridecafluoroundecyl)catechol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Tridecafluoroundecyl)catechol?
Yes, KEHONG BIO provides custom synthesis services for 3-(Tridecafluoroundecyl)catechol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.