Perfluorovinylacetic acid
TL;DR: Perfluorovinylacetic acid (CAS 7096-52-8) is a chemical compound with molecular formula C4HF5O2 and molecular weight 175.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,4,4-pentafluorobut-3-enoic acid
Also Known As: Perfluorovinylacetic acid, dPFLCA, n=4_iii, Di-t-butylzinnhydroxid-chlorid, 2,2,3,4,4-pentafluorobut-3-enoic acid, PENTAFLUOROBUT-3-ENOIC ACID
| Molecular Formula | C4HF5O2 |
|---|---|
| Molecular Weight | 175.99 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.98967 |
| Heavy Atoms | 11 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 7096-52-8 |
|---|---|
| SMILES | C(=C(F)F)(C(C(=O)O)(F)F)F |
| InChIKey | JULFZFLHGXXVRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Perfluorovinylacetic acid (CAS 7096-52-8), with molecular formula C4HF5O2 and molecular weight 175.99 g/mol. IUPAC: 2,2,3,4,4-pentafluorobut-3-enoic acid.
Chemical Property Profile of Perfluorovinylacetic acid
Property Insights of Perfluorovinylacetic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perfluorovinylacetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Perfluorovinylacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluorovinylacetic acid has 1 hydrogen bond donor(s) and 7 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 Perfluorovinylacetic acid?
The CAS number of Perfluorovinylacetic acid is 7096-52-8.
What is the molecular formula of Perfluorovinylacetic acid?
The molecular formula of Perfluorovinylacetic acid is C4HF5O2.
What is the molecular weight of Perfluorovinylacetic acid?
The molecular weight of Perfluorovinylacetic acid is 175.99 g/mol.
Where can I buy Perfluorovinylacetic acid?
You can request a quote for Perfluorovinylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluorovinylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for Perfluorovinylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.