Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-
TL;DR: Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- (CAS 77302-19-3) is a chemical compound with molecular formula C12H12F3NO and molecular weight 243.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-methyl-3-[3-(trifluoromethyl)phenyl]but-2-enamide
Also Known As: trans-alpha,beta-Dimethyl-m-trifluoromethylcinnamamide, alpha,beta-Dimethyl-m-trifluoromethylcinnamamide, CINNAMAMIDE, alpha,beta-DIMETHYL-m-TRIFLUOROMETHYL-, (E)-, (2E)-2-methyl-3-[3-(trifluoromethyl)phenyl]but-2-enamide, (E)-2-methyl-3-[3-(trifluoromethyl)phenyl]but-2-enamide
| Molecular Formula | C12H12F3NO |
|---|---|
| Molecular Weight | 243.09 g/mol |
| LogP | 2.9841 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.0871 |
| Heavy Atoms | 17 |
| Complexity | 474.88425 |
Chemical Identifiers
| CAS Number | 77302-19-3 |
|---|---|
| SMILES | C/C(=C(/C)\C(=O)N)/C1=CC(=CC=C1)C(F)(F)F |
Product Overview
Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- (CAS 77302-19-3), with molecular formula C12H12F3NO and molecular weight 243.09 g/mol. IUPAC: (E)-2-methyl-3-[3-(trifluoromethyl)phenyl]but-2-enamide.
Chemical Property Profile of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-
Property Insights of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-
The XLogP value of 2.9841 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-. With a topological polar surface area (TPSA) of 43.09 Ų, Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- has 1 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 Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-?
The CAS number of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- is 77302-19-3.
What is the molecular formula of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-?
The molecular formula of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- is C12H12F3NO.
What is the molecular weight of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-?
The molecular weight of Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- is 243.09 g/mol.
Where can I buy Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-?
You can request a quote for Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for Cinnamamide, alpha,beta-dimethyl-m-trifluoromethyl-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.