Ammonium octadecfluoro-9-(trifluoromethyl)decanoate
TL;DR: Ammonium octadecfluoro-9-(trifluoromethyl)decanoate (CAS 3658-63-7) is a chemical compound with molecular formula C11H4F21NO2 and molecular weight 580.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azane;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecanoic acid
Also Known As: Perfluoroundecanoic acid, henicosafluoroundecanoic acid ammoniate(1:1), Ammonium octadecafluoro-9-(trifluoromethyl)decanoate, Ammonium octadecfluoro-9-(trifluoromethyl)decanoate, Decanoic acid, octadecafluoro-9-(trifluoromethyl)-, ammonium salt
| Molecular Formula | C11H4F21NO2 |
|---|---|
| Molecular Weight | 580.99 g/mol |
| LogP | 6.51 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 9 |
| Exact Mass | 580.99066 |
| Heavy Atoms | 35 |
| Complexity | 789.0 |
Chemical Identifiers
| CAS Number | 3658-63-7 |
|---|---|
| SMILES | C(=O)(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O.N |
| InChIKey | SPNFQXXYDXWCJV-UHFFFAOYSA-N |
Product Overview
Ammonium octadecfluoro-9-(trifluoromethyl)decanoate (CAS 3658-63-7), with molecular formula C11H4F21NO2 and molecular weight 580.99 g/mol. IUPAC: azane;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecanoic acid.
Chemical Property Profile of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate
Property Insights of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate
The XLogP value of 6.51 indicates that Ammonium octadecfluoro-9-(trifluoromethyl)decanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium octadecfluoro-9-(trifluoromethyl)decanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium octadecfluoro-9-(trifluoromethyl)decanoate has 2 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate?
The CAS number of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate is 3658-63-7.
What is the molecular formula of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate?
The molecular formula of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate is C11H4F21NO2.
What is the molecular weight of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate?
The molecular weight of Ammonium octadecfluoro-9-(trifluoromethyl)decanoate is 580.99 g/mol.
Where can I buy Ammonium octadecfluoro-9-(trifluoromethyl)decanoate?
You can request a quote for Ammonium octadecfluoro-9-(trifluoromethyl)decanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium octadecfluoro-9-(trifluoromethyl)decanoate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium octadecfluoro-9-(trifluoromethyl)decanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.