4-Bromomethyl-benzoyl chloride
TL;DR: 4-Bromomethyl-benzoyl chloride (CAS 52780-16-2) is a chemical compound with molecular formula C8H6BrClO and molecular weight 231.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(bromomethyl)benzoyl chloride
Also Known As: 4-(bromomethyl)benzoyl Chloride, 4-Bromomethyl benzoyl chloride, 4-bromomethylbenzoyl chloride, 4-bromomethyl benzoylchloride, 4-bromomethyl-benzoyl chloride
| Molecular Formula | C8H6BrClO |
|---|---|
| Molecular Weight | 231.93 g/mol |
| LogP | 2.9605 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.92906 |
| Heavy Atoms | 11 |
| Complexity | 255.2995 |
Chemical Identifiers
| CAS Number | 52780-16-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CBr)C(=O)Cl |
Product Overview
4-Bromomethyl-benzoyl chloride (CAS 52780-16-2), with molecular formula C8H6BrClO and molecular weight 231.93 g/mol. IUPAC: 4-(bromomethyl)benzoyl chloride.
Chemical Property Profile of 4-Bromomethyl-benzoyl chloride
Property Insights of 4-Bromomethyl-benzoyl chloride
The XLogP value of 2.9605 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromomethyl-benzoyl chloride. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Bromomethyl-benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromomethyl-benzoyl 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
Frequently Asked Questions
What is the CAS number of 4-Bromomethyl-benzoyl chloride?
The CAS number of 4-Bromomethyl-benzoyl chloride is 52780-16-2.
What is the molecular formula of 4-Bromomethyl-benzoyl chloride?
The molecular formula of 4-Bromomethyl-benzoyl chloride is C8H6BrClO.
What is the molecular weight of 4-Bromomethyl-benzoyl chloride?
The molecular weight of 4-Bromomethyl-benzoyl chloride is 231.93 g/mol.
Where can I buy 4-Bromomethyl-benzoyl chloride?
You can request a quote for 4-Bromomethyl-benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromomethyl-benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromomethyl-benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.