3-(Dichloromethyl)benzoyl chloride
TL;DR: 3-(Dichloromethyl)benzoyl chloride (CAS 36747-51-0) is a chemical compound with molecular formula C8H5Cl3O and molecular weight 221.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dichloromethyl)benzoyl chloride
Also Known As: 3-(Dichloromethyl)benzoyl chloride, 3- benzoylchloride, 3-dichloromethylbenzoyl chloride, Benzoyl chloride,3-(dichloromethyl)-, Benzoyl chloride, 3-(dichloromethyl)-
| Molecular Formula | C8H5Cl3O |
|---|---|
| Molecular Weight | 221.94 g/mol |
| LogP | 3.5418 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.9406 |
| Heavy Atoms | 12 |
| Complexity | 296.10938 |
Chemical Identifiers
| CAS Number | 36747-51-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)Cl)C(Cl)Cl |
Product Overview
3-(Dichloromethyl)benzoyl chloride (CAS 36747-51-0), with molecular formula C8H5Cl3O and molecular weight 221.94 g/mol. IUPAC: 3-(dichloromethyl)benzoyl chloride.
Chemical Property Profile of 3-(Dichloromethyl)benzoyl chloride
Property Insights of 3-(Dichloromethyl)benzoyl chloride
The XLogP value of 3.5418 indicates that 3-(Dichloromethyl)benzoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3-(Dichloromethyl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dichloromethyl)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-(Dichloromethyl)benzoyl chloride?
The CAS number of 3-(Dichloromethyl)benzoyl chloride is 36747-51-0.
What is the molecular formula of 3-(Dichloromethyl)benzoyl chloride?
The molecular formula of 3-(Dichloromethyl)benzoyl chloride is C8H5Cl3O.
What is the molecular weight of 3-(Dichloromethyl)benzoyl chloride?
The molecular weight of 3-(Dichloromethyl)benzoyl chloride is 221.94 g/mol.
Where can I buy 3-(Dichloromethyl)benzoyl chloride?
You can request a quote for 3-(Dichloromethyl)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-(Dichloromethyl)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dichloromethyl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.