Methyl 7H-perfluoroheptanoate
TL;DR: Methyl 7H-perfluoroheptanoate (CAS 84567-13-5) is a chemical compound with molecular formula C8H4F12O2 and molecular weight 360.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoate
Also Known As: Methyl 7H-perfluoroheptanoate, METHYL7H-PERFLUOROHEPTANOATE, Methyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoate, 7H-Dodecafluoroheptanoic acid methyl ester, 7H-Perfluoroheptanoic acid methyl ester
| Molecular Formula | C8H4F12O2 |
|---|---|
| Molecular Weight | 360.00 g/mol |
| LogP | 3.601 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.00195 |
| Heavy Atoms | 22 |
| Complexity | 428.8422 |
Chemical Identifiers
| CAS Number | 84567-13-5 |
|---|---|
| SMILES | COC(=O)C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
Methyl 7H-perfluoroheptanoate (CAS 84567-13-5), with molecular formula C8H4F12O2 and molecular weight 360.00 g/mol. IUPAC: methyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptanoate.
Chemical Property Profile of Methyl 7H-perfluoroheptanoate
Property Insights of Methyl 7H-perfluoroheptanoate
The XLogP value of 3.601 indicates that Methyl 7H-perfluoroheptanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 7H-perfluoroheptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 7H-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 Methyl 7H-perfluoroheptanoate?
The CAS number of Methyl 7H-perfluoroheptanoate is 84567-13-5.
What is the molecular formula of Methyl 7H-perfluoroheptanoate?
The molecular formula of Methyl 7H-perfluoroheptanoate is C8H4F12O2.
What is the molecular weight of Methyl 7H-perfluoroheptanoate?
The molecular weight of Methyl 7H-perfluoroheptanoate is 360.00 g/mol.
Where can I buy Methyl 7H-perfluoroheptanoate?
You can request a quote for Methyl 7H-perfluoroheptanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 7H-perfluoroheptanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 7H-perfluoroheptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.