2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-
TL;DR: 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- (CAS 1163255-65-9) is a chemical compound with molecular formula C9H5ClF2O2 and molecular weight 217.99461 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-chloro-3,6-difluorophenyl)prop-2-enoic acid
Also Known As: 2-Chloro-3,6-difluorocinnamic acid, HgDpClH`iBYCHhhidbhppPQLpBI`, 3-(2-Chloro-3,6-difluorophenyl)acrylic acid, 3-(2-chloro-3,6-difluorophenyl)prop-2-enoic acid, 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-
Technical Specifications
| Molecular Formula | C9H5ClF2O2 |
| Molecular Weight | 217.99461 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.99461 Da |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
| SMILES | C1=CC(=C(C(=C1F)C=CC(=O)O)Cl)F |
| InChIKey | IHWVLAUNJHXFGN-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-
Property Insights of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-?
The CAS number of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- is 1163255-65-9.
What is the molecular formula of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-?
The molecular formula of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- is C9H5ClF2O2.
What is the molecular weight of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-?
The molecular weight of 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- is 217.99461 g/mol.
Where can I buy 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-?
You can request a quote for 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)-?
Yes, CoreyChem provides custom synthesis services for 2-Propenoic acid,3-(2-chloro-3,6-difluorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.