Heptafluorobutyric acid
TL;DR: Heptafluorobutyric acid (CAS 375-22-4) is a chemical compound with molecular formula C4HF7O2 and molecular weight 213.98648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,3,3,4,4,4-heptafluorobutanoic acid
Also Known As: Heptafluorobutyric acid, Perfluorobutyric acid, Perfluorobutanoic acid, Heptafluorobutanoic acid, Butanoic acid, heptafluoro-
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4HF7O2 |
| Molecular Weight | 213.98648 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.98648 Da |
| Heavy Atoms | 13 |
| Complexity | 217.0 |
| Boiling Point | 120.8 °C @760 [mm Hg] |
| Density | 1.645 @25 °C |
| SMILES | C(=O)(C(C(C(F)(F)F)(F)F)(F)F)O |
| InChIKey | YPJUNDFVDDCYIH-UHFFFAOYSA-N |
Product Description
Applications: Heptafluorobutyric acid is used in pharmaceutical synthesis routes and API production, as well as peptide synthesis and amino acid derivative chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Heptafluorobutyric acid is a pharmaceutical intermediate identified by CAS number 375-22-4 and the molecular formula C4HF7O2 and a molecular weight of 213.99 g/mol. Physically, the compound has a density of 1.645 @25 °C g/cm³. Synonyms include Heptafluorobutyric acid and Perfluorobutyric acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Heptafluorobutyric acid
Property Insights of Heptafluorobutyric acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptafluorobutyric acid. With a topological polar surface area (TPSA) of 37.3 Ų, Heptafluorobutyric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptafluorobutyric acid has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Heptafluorobutyric acid?
The CAS number of Heptafluorobutyric acid is 375-22-4.
What is the molecular formula of Heptafluorobutyric acid?
The molecular formula of Heptafluorobutyric acid is C4HF7O2.
What is the molecular weight of Heptafluorobutyric acid?
The molecular weight of Heptafluorobutyric acid is 213.98648 g/mol.
What are the applications of Heptafluorobutyric acid?
Heptafluorobutyric acid is used in pharmaceutical synthesis routes and API production, as well as peptide synthesis and amino acid derivative chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis...
Where can I buy Heptafluorobutyric acid?
You can request a quote for Heptafluorobutyric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Heptafluorobutyric acid?
Yes, CoreyChem provides custom synthesis services for Heptafluorobutyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.