3-(Trifluoromethyl)cinnamide
TL;DR: 3-(Trifluoromethyl)cinnamide (CAS 93974-08-4) is a chemical compound with molecular formula C10H8F3NO and molecular weight 215.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Also Known As: 3-(Trifluoromethyl)cinnamide, m-(Trifluoromethyl)cinnamamide, M-(trifluoromethyl)cinnamide, m-Trifluoromethylcinnamamide, trans-m-Trifluoromethylcinnamamide
| Molecular Formula | C10H8F3NO |
|---|---|
| Molecular Weight | 215.06 g/mol |
| LogP | 2.2039 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.0558 |
| Heavy Atoms | 15 |
| Complexity | 395.89914 |
Chemical Identifiers
| CAS Number | 93974-08-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)/C=C/C(=O)N |
Product Overview
3-(Trifluoromethyl)cinnamide (CAS 93974-08-4), with molecular formula C10H8F3NO and molecular weight 215.06 g/mol. IUPAC: (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide.
Chemical Property Profile of 3-(Trifluoromethyl)cinnamide
Property Insights of 3-(Trifluoromethyl)cinnamide
The XLogP value of 2.2039 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Trifluoromethyl)cinnamide. With a topological polar surface area (TPSA) of 43.09 Ų, 3-(Trifluoromethyl)cinnamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethyl)cinnamide 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 3-(Trifluoromethyl)cinnamide?
The CAS number of 3-(Trifluoromethyl)cinnamide is 93974-08-4.
What is the molecular formula of 3-(Trifluoromethyl)cinnamide?
The molecular formula of 3-(Trifluoromethyl)cinnamide is C10H8F3NO.
What is the molecular weight of 3-(Trifluoromethyl)cinnamide?
The molecular weight of 3-(Trifluoromethyl)cinnamide is 215.06 g/mol.
Where can I buy 3-(Trifluoromethyl)cinnamide?
You can request a quote for 3-(Trifluoromethyl)cinnamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Trifluoromethyl)cinnamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Trifluoromethyl)cinnamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.