4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride
TL;DR: 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride (CAS 7477-66-9) is a chemical compound with molecular formula C10H6BrClO2 and molecular weight 271.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromophenyl)-4-oxobut-2-enoyl chloride
Also Known As: 4-(4-bromophenyl)-4-oxobut-2-enoyl chloride
| Molecular Formula | C10H6BrClO2 |
|---|---|
| Molecular Weight | 271.92 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.92398 |
| Heavy Atoms | 14 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 7477-66-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C=CC(=O)Cl)Br |
| InChIKey | CKHMRUPKNSXZIQ-UHFFFAOYSA-N |
Product Overview
4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride (CAS 7477-66-9), with molecular formula C10H6BrClO2 and molecular weight 271.92 g/mol. IUPAC: 4-(4-bromophenyl)-4-oxobut-2-enoyl chloride.
Chemical Property Profile of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride
Property Insights of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride
The XLogP value of 3.2 indicates that 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride?
The CAS number of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride is 7477-66-9.
What is the molecular formula of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride?
The molecular formula of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride is C10H6BrClO2.
What is the molecular weight of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride?
The molecular weight of 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride is 271.92 g/mol.
Where can I buy 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride?
You can request a quote for 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Bromophenyl)-4-oxobut-2-enoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.