3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-
TL;DR: 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- (CAS 106578-69-2) is a chemical compound with molecular formula C16H12F3NO and molecular weight 291.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-anilino-1,1,1-trifluoro-4-phenylbut-3-en-2-one
Also Known As: AB00111535-01, (Z)-4-anilino-1,1,1-trifluoro-4-phenylbut-3-en-2-one, (Z)-1,1,1-trifluoro-4-phenyl-4-(phenylamino)but-3-en-2-one, (3Z)-1,1,1-trifluoro-4-phenyl-4-(phenylamino)but-3-en-2-one, 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-
| Molecular Formula | C16H12F3NO |
|---|---|
| Molecular Weight | 291.09 g/mol |
| LogP | 4.271 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.0871 |
| Heavy Atoms | 21 |
| Complexity | 633.5766 |
Chemical Identifiers
| CAS Number | 106578-69-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C/C(=O)C(F)(F)F)/NC2=CC=CC=C2 |
Product Overview
3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- (CAS 106578-69-2), with molecular formula C16H12F3NO and molecular weight 291.09 g/mol. IUPAC: (Z)-4-anilino-1,1,1-trifluoro-4-phenylbut-3-en-2-one.
Chemical Property Profile of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-
Property Insights of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-
The XLogP value of 4.271 indicates that 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- has 1 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-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-?
The CAS number of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- is 106578-69-2.
What is the molecular formula of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-?
The molecular formula of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- is C16H12F3NO.
What is the molecular weight of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-?
The molecular weight of 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- is 291.09 g/mol.
Where can I buy 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-?
You can request a quote for 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Buten-2-one, 1,1,1-trifluoro-4-phenyl-4-(phenylamino)-, (3Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.