3-(2-Chlorophenyl)prop-2-enoyl chloride
TL;DR: 3-(2-Chlorophenyl)prop-2-enoyl chloride (CAS 120681-06-3) is a chemical compound with molecular formula C9H6Cl2O and molecular weight 199.97957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-chlorophenyl)prop-2-enoyl chloride
Also Known As: 2-Chlorocinnamoyl chloride, 2-CHLOROCINNAMIC ACID CHLORIDE, 3-(2-chlorophenyl)prop-2-enoyl chloride, 3-(2-Chlorophenyl)acryloyl chloride, (e)-3-(2-chlorophenyl)acryloyl chloride
Technical Specifications
| Molecular Formula | C9H6Cl2O |
| Molecular Weight | 199.97957 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.97957 Da |
| Heavy Atoms | 12 |
| Complexity | 189.0 |
| SMILES | C1=CC=C(C(=C1)C=CC(=O)Cl)Cl |
| InChIKey | ZAUFNZFFWDQKPL-UHFFFAOYSA-N |
Chemical Property Profile of 3-(2-Chlorophenyl)prop-2-enoyl chloride
Property Insights of 3-(2-Chlorophenyl)prop-2-enoyl chloride
The XLogP value of 3.5 indicates that 3-(2-Chlorophenyl)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-Chlorophenyl)prop-2-enoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chlorophenyl)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-Chlorophenyl)prop-2-enoyl chloride?
The CAS number of 3-(2-Chlorophenyl)prop-2-enoyl chloride is 120681-06-3.
What is the molecular formula of 3-(2-Chlorophenyl)prop-2-enoyl chloride?
The molecular formula of 3-(2-Chlorophenyl)prop-2-enoyl chloride is C9H6Cl2O.
What is the molecular weight of 3-(2-Chlorophenyl)prop-2-enoyl chloride?
The molecular weight of 3-(2-Chlorophenyl)prop-2-enoyl chloride is 199.97957 g/mol.
Where can I buy 3-(2-Chlorophenyl)prop-2-enoyl chloride?
You can request a quote for 3-(2-Chlorophenyl)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-Chlorophenyl)prop-2-enoyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-(2-Chlorophenyl)prop-2-enoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.