![(3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one structure](/static/products/797/797019-19-3.png)
(3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one
TL;DR: (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one (CAS 797019-19-3) is a chemical compound with molecular formula C11H10F3NO2 and molecular weight 245.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1,1,1-trifluoro-4-(2-methoxyanilino)but-3-en-2-one
Also Known As: (E)-1,1,1-trifluoro-4-(2-methoxyanilino)but-3-en-2-one, (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one, (E)-1,1,1-trifluoro-4-((2-methoxyphenyl)amino)but-3-en-2-one
| Molecular Formula | C11H10F3NO2 |
|---|---|
| Molecular Weight | 245.07 g/mol |
| LogP | 2.7522 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.06636 |
| Heavy Atoms | 17 |
| Complexity | 426.96988 |
Chemical Identifiers
| CAS Number | 797019-19-3 |
|---|---|
| SMILES | COC1=CC=CC=C1N/C=C/C(=O)C(F)(F)F |
Product Overview
(3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one (CAS 797019-19-3), with molecular formula C11H10F3NO2 and molecular weight 245.07 g/mol. IUPAC: (E)-1,1,1-trifluoro-4-(2-methoxyanilino)but-3-en-2-one.
Chemical Property Profile of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one
Property Insights of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one
The XLogP value of 2.7522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one. With a topological polar surface area (TPSA) of 38.33 Ų, (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one has 1 hydrogen bond donor(s) and 3 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 (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one?
The CAS number of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one is 797019-19-3.
What is the molecular formula of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one?
The molecular formula of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one is C11H10F3NO2.
What is the molecular weight of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one?
The molecular weight of (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one is 245.07 g/mol.
Where can I buy (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one?
You can request a quote for (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.