Prop-2-en-1-yl heptadecafluorononanoate
TL;DR: Prop-2-en-1-yl heptadecafluorononanoate (CAS 117639-11-9) is a chemical compound with molecular formula C12H5F17O2 and molecular weight 504.0018 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
prop-2-enyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoate
Also Known As: Allyl perfluorononanoate, Allyl perfluoro-n-nonanoate, allylperfluorononanoate, Allylperfluoro-N-nonanoate, Prop-2-en-1-yl heptadecafluorononanoate
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H5F17O2 |
| Molecular Weight | 504.0018 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 10 |
| Exact Mass | 504.0018 Da |
| Heavy Atoms | 31 |
| Complexity | 690.0 |
| SMILES | C=CCOC(=O)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 |
| InChIKey | DCARDCAPXKDJAG-UHFFFAOYSA-N |
Chemical Property Profile of Prop-2-en-1-yl heptadecafluorononanoate
Property Insights of Prop-2-en-1-yl heptadecafluorononanoate
The XLogP value of 6.6 indicates that Prop-2-en-1-yl heptadecafluorononanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Prop-2-en-1-yl heptadecafluorononanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Prop-2-en-1-yl heptadecafluorononanoate has 0 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Prop-2-en-1-yl heptadecafluorononanoate?
The CAS number of Prop-2-en-1-yl heptadecafluorononanoate is 117639-11-9.
What is the molecular formula of Prop-2-en-1-yl heptadecafluorononanoate?
The molecular formula of Prop-2-en-1-yl heptadecafluorononanoate is C12H5F17O2.
What is the molecular weight of Prop-2-en-1-yl heptadecafluorononanoate?
The molecular weight of Prop-2-en-1-yl heptadecafluorononanoate is 504.0018 g/mol.
Where can I buy Prop-2-en-1-yl heptadecafluorononanoate?
You can request a quote for Prop-2-en-1-yl heptadecafluorononanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Prop-2-en-1-yl heptadecafluorononanoate?
Yes, CoreyChem provides custom synthesis services for Prop-2-en-1-yl heptadecafluorononanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.