3-(2,6-Dichlorophenyl)prop-2-enoyl chloride
TL;DR: 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride (CAS 230305-41-6) is a chemical compound with molecular formula C9H5Cl3O and molecular weight 233.9406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2,6-dichlorophenyl)prop-2-enoyl chloride
Also Known As: 2,6-Dichlorocinnamoyl chloride, 3-(2,6-dichlorophenyl)prop-2-enoyl chloride, 3-(2,6-Dichlorophenyl)propenoyl chloride, (E)-3-(2,6-dichlorophenyl)prop-2-enoyl chloride, (2E)-3-(2,6-DICHLOROPHENYL)ACRYLOYL CHLORIDE
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H5Cl3O |
| Molecular Weight | 233.9406 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.9406 Da |
| Heavy Atoms | 13 |
| Complexity | 205.0 |
| SMILES | C1=CC(=C(C(=C1)Cl)C=CC(=O)Cl)Cl |
| InChIKey | RTQDVNBXNNTDDK-UHFFFAOYSA-N |
Chemical Property Profile of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride
Property Insights of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride
The XLogP value of 4.1 indicates that 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride?
The CAS number of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride is 230305-41-6.
What is the molecular formula of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride?
The molecular formula of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride is C9H5Cl3O.
What is the molecular weight of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride?
The molecular weight of 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride is 233.9406 g/mol.
Where can I buy 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride?
You can request a quote for 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-(2,6-Dichlorophenyl)prop-2-enoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.