2,4-Dichloro-3,5-dimethylphenyl acetate
TL;DR: 2,4-Dichloro-3,5-dimethylphenyl acetate (CAS 99421-62-2) is a chemical compound with molecular formula C10H10Cl2O2 and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichloro-3,5-dimethylphenyl) acetate
Also Known As: 2,4-Dichloro-3,5-dimethylphenyl acetate, 3,5-Xylenol, 2,4-dichloro-, acetate, (2,4-dichloro-3,5-dimethylphenyl) acetate, 2,4-Dichloro-3,5-dimethylphenol acetate, 2,4-Dichloro-3,5-dimethylphenyl acetate #
| Molecular Formula | C10H10Cl2O2 |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.00578 |
| Heavy Atoms | 14 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 99421-62-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1Cl)C)Cl)OC(=O)C |
| InChIKey | ISSMUYNVNZDWDF-UHFFFAOYSA-N |
Product Overview
2,4-Dichloro-3,5-dimethylphenyl acetate (CAS 99421-62-2), with molecular formula C10H10Cl2O2 and molecular weight 232.01 g/mol. IUPAC: (2,4-dichloro-3,5-dimethylphenyl) acetate.
Chemical Property Profile of 2,4-Dichloro-3,5-dimethylphenyl acetate
Property Insights of 2,4-Dichloro-3,5-dimethylphenyl acetate
The XLogP value of 3.7 indicates that 2,4-Dichloro-3,5-dimethylphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,4-Dichloro-3,5-dimethylphenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloro-3,5-dimethylphenyl 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 2,4-Dichloro-3,5-dimethylphenyl acetate?
The CAS number of 2,4-Dichloro-3,5-dimethylphenyl acetate is 99421-62-2.
What is the molecular formula of 2,4-Dichloro-3,5-dimethylphenyl acetate?
The molecular formula of 2,4-Dichloro-3,5-dimethylphenyl acetate is C10H10Cl2O2.
What is the molecular weight of 2,4-Dichloro-3,5-dimethylphenyl acetate?
The molecular weight of 2,4-Dichloro-3,5-dimethylphenyl acetate is 232.01 g/mol.
Where can I buy 2,4-Dichloro-3,5-dimethylphenyl acetate?
You can request a quote for 2,4-Dichloro-3,5-dimethylphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-3,5-dimethylphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-3,5-dimethylphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.