![(2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal structure](/static/products/1635/163563-21-1.webp)
(2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal
TL;DR: (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal (CAS 163563-21-1) is a chemical compound with molecular formula C12H12F3NO and molecular weight 243.0871 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal
Also Known As: (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal, 5J-579S, 3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]acrylaldehyde, (Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal, 2-(m-trifluoromethylphenyl)-3-dimethylaminoprop-2-enal
Technical Specifications
| Molecular Formula | C12H12F3NO |
| Molecular Weight | 243.0871 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.0871 Da |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
| SMILES | CN(C)/C=C(\C=O)/C1=CC(=CC=C1)C(F)(F)F |
| InChIKey | KFCUNHHGLYPCDW-JXMROGBWSA-N |
Chemical Property Profile of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal
Property Insights of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal. With a topological polar surface area (TPSA) of 20.3 Ų, (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal?
The CAS number of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal is 163563-21-1.
What is the molecular formula of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal?
The molecular formula of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal is C12H12F3NO.
What is the molecular weight of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal?
The molecular weight of (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal is 243.0871 g/mol.
Where can I buy (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal?
You can request a quote for (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal?
Yes, CoreyChem provides custom synthesis services for (2Z)-3-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]prop-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.