3-Chlorophenoxyacetyl chloride
TL;DR: 3-Chlorophenoxyacetyl chloride (CAS 114476-84-5) is a chemical compound with molecular formula C8H6Cl2O2 and molecular weight 203.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenoxy)acetyl chloride
Also Known As: 3-CHLOROPHENOXYACETYL CHLORIDE, 2-(3-chlorophenoxy)acetyl chloride, (3-Chlorophenoxy)acetyl chloride, 3-CHLOROPHENOXYACETYLCHLORIDE, Acetyl chloride, (3-chlorophenoxy)-
| Molecular Formula | C8H6Cl2O2 |
|---|---|
| Molecular Weight | 203.97 g/mol |
| LogP | 2.4842 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.97449 |
| Heavy Atoms | 12 |
| Complexity | 286.14127 |
Chemical Identifiers
| CAS Number | 114476-84-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)OCC(=O)Cl |
Product Overview
3-Chlorophenoxyacetyl chloride (CAS 114476-84-5), with molecular formula C8H6Cl2O2 and molecular weight 203.97 g/mol. IUPAC: 2-(3-chlorophenoxy)acetyl chloride.
Chemical Property Profile of 3-Chlorophenoxyacetyl chloride
Property Insights of 3-Chlorophenoxyacetyl chloride
The XLogP value of 2.4842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chlorophenoxyacetyl chloride. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Chlorophenoxyacetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chlorophenoxyacetyl 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 3-Chlorophenoxyacetyl chloride?
The CAS number of 3-Chlorophenoxyacetyl chloride is 114476-84-5.
What is the molecular formula of 3-Chlorophenoxyacetyl chloride?
The molecular formula of 3-Chlorophenoxyacetyl chloride is C8H6Cl2O2.
What is the molecular weight of 3-Chlorophenoxyacetyl chloride?
The molecular weight of 3-Chlorophenoxyacetyl chloride is 203.97 g/mol.
Where can I buy 3-Chlorophenoxyacetyl chloride?
You can request a quote for 3-Chlorophenoxyacetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chlorophenoxyacetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Chlorophenoxyacetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.