3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal
TL;DR: 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal (CAS 131118-41-7) is a chemical compound with molecular formula C5H3F7O and molecular weight 212.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4,4-tetrafluoro-3-(trifluoromethyl)butanal
Also Known As: 3,4,4,4-tetrafluoro-3-(trifluoromethyl)butanal, RefChem:270482
| Molecular Formula | C5H3F7O |
|---|---|
| Molecular Weight | 212.01 g/mol |
| LogP | 2.4083 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.00722 |
| Heavy Atoms | 13 |
| Complexity | 176.04004 |
Chemical Identifiers
| CAS Number | 131118-41-7 |
|---|---|
| SMILES | C(C=O)C(C(F)(F)F)(C(F)(F)F)F |
Product Overview
3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal (CAS 131118-41-7), with molecular formula C5H3F7O and molecular weight 212.01 g/mol. IUPAC: 3,4,4,4-tetrafluoro-3-(trifluoromethyl)butanal.
Chemical Property Profile of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal
Property Insights of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal
The XLogP value of 2.4083 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal. With a topological polar surface area (TPSA) of 17.07 Ų, 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal has 0 hydrogen bond donor(s) and 1 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 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal?
The CAS number of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal is 131118-41-7.
What is the molecular formula of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal?
The molecular formula of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal is C5H3F7O.
What is the molecular weight of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal?
The molecular weight of 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal is 212.01 g/mol.
Where can I buy 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal?
You can request a quote for 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal?
Yes, KEHONG BIO provides custom synthesis services for 3,4,4,4-Tetrafluoro-3-(trifluoromethyl)butanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.