3-(4-Bromophenyl)-3-chloro-2-propenal
TL;DR: 3-(4-Bromophenyl)-3-chloro-2-propenal (CAS 14063-78-6) is a chemical compound with molecular formula C9H6BrClO and molecular weight 243.92906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-bromophenyl)-3-chloroprop-2-enal
Also Known As: 3-(4-bromophenyl)-3-chloropropenal, p-Bromo-beta-chlorocinnamaldehyde, 3-(4-Bromophenyl)-3-chloro-2-propenal, 5-p-Tolyl-isoxazole-3-carboxylic acid, 3-(4-BROMOPHENYL)-3-CHLOROPROP-2-ENAL
Technical Specifications
| Molecular Formula | C9H6BrClO |
| Molecular Weight | 243.92906 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.92906 Da |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
| SMILES | C1=CC(=CC=C1C(=CC=O)Cl)Br |
| InChIKey | BMEIVZSKOZFHRN-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-Bromophenyl)-3-chloro-2-propenal
Property Insights of 3-(4-Bromophenyl)-3-chloro-2-propenal
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Bromophenyl)-3-chloro-2-propenal. With a topological polar surface area (TPSA) of 17.1 Ų, 3-(4-Bromophenyl)-3-chloro-2-propenal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Bromophenyl)-3-chloro-2-propenal 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-(4-Bromophenyl)-3-chloro-2-propenal?
The CAS number of 3-(4-Bromophenyl)-3-chloro-2-propenal is 14063-78-6.
What is the molecular formula of 3-(4-Bromophenyl)-3-chloro-2-propenal?
The molecular formula of 3-(4-Bromophenyl)-3-chloro-2-propenal is C9H6BrClO.
What is the molecular weight of 3-(4-Bromophenyl)-3-chloro-2-propenal?
The molecular weight of 3-(4-Bromophenyl)-3-chloro-2-propenal is 243.92906 g/mol.
Where can I buy 3-(4-Bromophenyl)-3-chloro-2-propenal?
You can request a quote for 3-(4-Bromophenyl)-3-chloro-2-propenal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-Bromophenyl)-3-chloro-2-propenal?
Yes, CoreyChem provides custom synthesis services for 3-(4-Bromophenyl)-3-chloro-2-propenal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.