3,3,3-Trifluoro-2-oxopropanal
TL;DR: 3,3,3-Trifluoro-2-oxopropanal (CAS 91944-47-7) is a chemical compound with molecular formula C3HF3O2 and molecular weight 125.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,3-trifluoro-2-oxopropanal
Also Known As: 3,3,3-trifluoro-2-oxopropanal, TRIFLUOROPYRUVIC ALDEHYDE, Trifluoromethylglyoxal, TFPAD, TRIFLUOROPYRUVICALDEHYDE
| Molecular Formula | C3HF3O2 |
|---|---|
| Molecular Weight | 125.99 g/mol |
| LogP | 0.3167 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.99287 |
| Heavy Atoms | 8 |
| Complexity | 114.187164 |
Chemical Identifiers
| CAS Number | 91944-47-7 |
|---|---|
| SMILES | C(=O)C(=O)C(F)(F)F |
Product Overview
3,3,3-Trifluoro-2-oxopropanal (CAS 91944-47-7), with molecular formula C3HF3O2 and molecular weight 125.99 g/mol. IUPAC: 3,3,3-trifluoro-2-oxopropanal.
Chemical Property Profile of 3,3,3-Trifluoro-2-oxopropanal
Property Insights of 3,3,3-Trifluoro-2-oxopropanal
The XLogP value of 0.3167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,3-Trifluoro-2-oxopropanal. With a topological polar surface area (TPSA) of 34.14 Ų, 3,3,3-Trifluoro-2-oxopropanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,3-Trifluoro-2-oxopropanal has 0 hydrogen bond donor(s) and 2 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 3,3,3-Trifluoro-2-oxopropanal?
The CAS number of 3,3,3-Trifluoro-2-oxopropanal is 91944-47-7.
What is the molecular formula of 3,3,3-Trifluoro-2-oxopropanal?
The molecular formula of 3,3,3-Trifluoro-2-oxopropanal is C3HF3O2.
What is the molecular weight of 3,3,3-Trifluoro-2-oxopropanal?
The molecular weight of 3,3,3-Trifluoro-2-oxopropanal is 125.99 g/mol.
Where can I buy 3,3,3-Trifluoro-2-oxopropanal?
You can request a quote for 3,3,3-Trifluoro-2-oxopropanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,3-Trifluoro-2-oxopropanal?
Yes, KEHONG BIO provides custom synthesis services for 3,3,3-Trifluoro-2-oxopropanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.