RefChem:869134
TL;DR: RefChem:869134 (CAS 69116-72-9) is a chemical compound with molecular formula C7H3F9O4 and molecular weight 321.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2,3,3-tetrafluoro-3-(1,1,1,2,3-pentafluoro-3-oxopropan-2-yl)oxypropanoate
Also Known As: Methyl perfluoro[5-(fluoroformyl)-4-oxahexanoate], Propanoic acid, 2,2,3,3-tetrafluoro-3-[1,2,2,2-tetrafluoro-1-(fluorocarbonyl)ethoxy]-, methyl ester, Propionic acid, tetrafluoro-3-(tetrafluoro-1-(fluoroformyl)ethoxy)-, methyl ester, methyl 2,2,3,3-tetrafluoro-3-[(1,1,1,2,3-pentafluoro-3-oxopropan-2-yl)oxy]propanoate, methyl 2,2,3,3-tetrafluoro-3-(1,1,1,2,3-pentafluoro-3-oxo-propan-2-yl)oxy-propanoate
| Molecular Formula | C7H3F9O4 |
|---|---|
| Molecular Weight | 321.99 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.98877 |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 69116-72-9 |
|---|---|
| SMILES | COC(=O)C(C(OC(C(=O)F)(C(F)(F)F)F)(F)F)(F)F |
| InChIKey | YZXATMRKZPAQSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:869134 (CAS 69116-72-9), with molecular formula C7H3F9O4 and molecular weight 321.99 g/mol. IUPAC: methyl 2,2,3,3-tetrafluoro-3-(1,1,1,2,3-pentafluoro-3-oxopropan-2-yl)oxypropanoate.
Chemical Property Profile of RefChem:869134
Property Insights of RefChem:869134
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:869134. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:869134 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:869134 has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:869134?
The CAS number of RefChem:869134 is 69116-72-9.
What is the molecular formula of RefChem:869134?
The molecular formula of RefChem:869134 is C7H3F9O4.
What is the molecular weight of RefChem:869134?
The molecular weight of RefChem:869134 is 321.99 g/mol.
Where can I buy RefChem:869134?
You can request a quote for RefChem:869134 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:869134?
Yes, KEHONG BIO provides custom synthesis services for RefChem:869134 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.