3-(Chloromethyl)benzoyl chloride
TL;DR: 3-(Chloromethyl)benzoyl chloride (CAS 63024-77-1) is a chemical compound with molecular formula C8H6Cl2O and molecular weight 187.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)benzoyl chloride
Also Known As: 3-(Chloromethyl)benzoyl chloride, H-Glu-OBzl, 3-Chloromethyl-benzoyl chloride, 3-(Chloromethyl)-benzoyl chloride, 3-(Chloromethyl)benzoylchloride
| Molecular Formula | C8H6Cl2O |
|---|---|
| Molecular Weight | 187.98 g/mol |
| LogP | 2.8044 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.97957 |
| Heavy Atoms | 11 |
| Complexity | 270.5495 |
Chemical Identifiers
| CAS Number | 63024-77-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)Cl)CCl |
Product Overview
3-(Chloromethyl)benzoyl chloride (CAS 63024-77-1), with molecular formula C8H6Cl2O and molecular weight 187.98 g/mol. IUPAC: 3-(chloromethyl)benzoyl chloride.
Chemical Property Profile of 3-(Chloromethyl)benzoyl chloride
Property Insights of 3-(Chloromethyl)benzoyl chloride
The XLogP value of 2.8044 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Chloromethyl)benzoyl chloride. With a topological polar surface area (TPSA) of 17.07 Ų, 3-(Chloromethyl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Chloromethyl)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 3-(Chloromethyl)benzoyl chloride?
The CAS number of 3-(Chloromethyl)benzoyl chloride is 63024-77-1.
What is the molecular formula of 3-(Chloromethyl)benzoyl chloride?
The molecular formula of 3-(Chloromethyl)benzoyl chloride is C8H6Cl2O.
What is the molecular weight of 3-(Chloromethyl)benzoyl chloride?
The molecular weight of 3-(Chloromethyl)benzoyl chloride is 187.98 g/mol.
Where can I buy 3-(Chloromethyl)benzoyl chloride?
You can request a quote for 3-(Chloromethyl)benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Chloromethyl)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(Chloromethyl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.