Hexafluorocyclobutanone
TL;DR: Hexafluorocyclobutanone (CAS 699-35-4) is a chemical compound with molecular formula C4F6O and molecular weight 177.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4-hexafluorocyclobutan-1-one
Also Known As: Hexafluorocyclobutanone, perfluorocyclobutanone, HEXAFLUOROCYCLOBUTAN-1-ONE, 2,2,3,3,4,4-hexafluorocyclobutan-1-one, RefChem:347506
| Molecular Formula | C4F6O |
|---|---|
| Molecular Weight | 177.99 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.98534 |
| Heavy Atoms | 11 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 699-35-4 |
|---|---|
| SMILES | C1(=O)C(C(C1(F)F)(F)F)(F)F |
| InChIKey | OKMQQXIEPRGARV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexafluorocyclobutanone (CAS 699-35-4), with molecular formula C4F6O and molecular weight 177.99 g/mol. IUPAC: 2,2,3,3,4,4-hexafluorocyclobutan-1-one.
Chemical Property Profile of Hexafluorocyclobutanone
Property Insights of Hexafluorocyclobutanone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexafluorocyclobutanone. With a topological polar surface area (TPSA) of 17.1 Ų, Hexafluorocyclobutanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexafluorocyclobutanone has 0 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 Hexafluorocyclobutanone?
The CAS number of Hexafluorocyclobutanone is 699-35-4.
What is the molecular formula of Hexafluorocyclobutanone?
The molecular formula of Hexafluorocyclobutanone is C4F6O.
What is the molecular weight of Hexafluorocyclobutanone?
The molecular weight of Hexafluorocyclobutanone is 177.99 g/mol.
Where can I buy Hexafluorocyclobutanone?
You can request a quote for Hexafluorocyclobutanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexafluorocyclobutanone?
Yes, KEHONG BIO provides custom synthesis services for Hexafluorocyclobutanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.