Phenol, 2,6-dichloro-, 1-acetate
TL;DR: Phenol, 2,6-dichloro-, 1-acetate (CAS 28165-71-1) 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.
(2,6-dichlorophenyl) acetate
Also Known As: 2,6-Dichlorophenyl acetate, 2,6-Dichlorophenol acetate, (2,6-dichlorophenyl) acetate, Dotinurad Impurity 214, Phenol, 2,6-dichloro-, acetate
| Molecular Formula | C8H6Cl2O2 |
|---|---|
| Molecular Weight | 203.97 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.97449 |
| Heavy Atoms | 12 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 28165-71-1 |
|---|---|
| SMILES | CC(=O)OC1=C(C=CC=C1Cl)Cl |
| InChIKey | YNSMUWSJRXDNLN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2,6-dichloro-, 1-acetate (CAS 28165-71-1), with molecular formula C8H6Cl2O2 and molecular weight 203.97 g/mol. IUPAC: (2,6-dichlorophenyl) acetate.
Chemical Property Profile of Phenol, 2,6-dichloro-, 1-acetate
Property Insights of Phenol, 2,6-dichloro-, 1-acetate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 2,6-dichloro-, 1-acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Phenol, 2,6-dichloro-, 1-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,6-dichloro-, 1-acetate 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 Phenol, 2,6-dichloro-, 1-acetate?
The CAS number of Phenol, 2,6-dichloro-, 1-acetate is 28165-71-1.
What is the molecular formula of Phenol, 2,6-dichloro-, 1-acetate?
The molecular formula of Phenol, 2,6-dichloro-, 1-acetate is C8H6Cl2O2.
What is the molecular weight of Phenol, 2,6-dichloro-, 1-acetate?
The molecular weight of Phenol, 2,6-dichloro-, 1-acetate is 203.97 g/mol.
Where can I buy Phenol, 2,6-dichloro-, 1-acetate?
You can request a quote for Phenol, 2,6-dichloro-, 1-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,6-dichloro-, 1-acetate?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,6-dichloro-, 1-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.