Perfluoroheptanoate
TL;DR: Perfluoroheptanoate (CAS 120885-29-2) is a chemical compound with molecular formula C7F13O2- and molecular weight 362.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate
Also Known As: perfluoroheptanoate, tridecafluoroheptanoate, PFHpA ion, 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate, Heptanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-, methyl ester
| Molecular Formula | C7F13O2- |
|---|---|
| Molecular Weight | 362.97 g/mol |
| LogP | 2.4751 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.96906 |
| Heavy Atoms | 22 |
| Complexity | 447.7952 |
Chemical Identifiers
| CAS Number | 120885-29-2 |
|---|---|
| SMILES | C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-] |
Product Overview
Perfluoroheptanoate (CAS 120885-29-2), with molecular formula C7F13O2- and molecular weight 362.97 g/mol. IUPAC: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate.
Chemical Property Profile of Perfluoroheptanoate
Property Insights of Perfluoroheptanoate
The XLogP value of 2.4751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perfluoroheptanoate. With a topological polar surface area (TPSA) of 40.13 Ų, Perfluoroheptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluoroheptanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Perfluoroheptanoate?
The CAS number of Perfluoroheptanoate is 120885-29-2.
What is the molecular formula of Perfluoroheptanoate?
The molecular formula of Perfluoroheptanoate is C7F13O2-.
What is the molecular weight of Perfluoroheptanoate?
The molecular weight of Perfluoroheptanoate is 362.97 g/mol.
Where can I buy Perfluoroheptanoate?
You can request a quote for Perfluoroheptanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluoroheptanoate?
Yes, KEHONG BIO provides custom synthesis services for Perfluoroheptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.