Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester
TL;DR: Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester (CAS 13246-97-4) is a chemical compound with molecular formula C15H12Cl2O3 and molecular weight 310.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(2,4-dichlorophenoxy)acetate
Also Known As: benzyl (2,4-dichlorophenoxy)acetate, benzyl 2-(2,4-dichlorophenoxy)acetate, Phenylmethyl 2-(2,4-dichlorophenoxy)acetate, BIM-0046148.P001, Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester
| Molecular Formula | C15H12Cl2O3 |
|---|---|
| Molecular Weight | 310.02 g/mol |
| LogP | 4.1156 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.01636 |
| Heavy Atoms | 20 |
| Complexity | 584.9274 |
Chemical Identifiers
| CAS Number | 13246-97-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)COC2=C(C=C(C=C2)Cl)Cl |
Product Overview
Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester (CAS 13246-97-4), with molecular formula C15H12Cl2O3 and molecular weight 310.02 g/mol. IUPAC: benzyl 2-(2,4-dichlorophenoxy)acetate.
Chemical Property Profile of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester
Property Insights of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester
The XLogP value of 4.1156 indicates that Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester has 0 hydrogen bond donor(s) and 3 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 Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester?
The CAS number of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester is 13246-97-4.
What is the molecular formula of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester?
The molecular formula of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester is C15H12Cl2O3.
What is the molecular weight of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester?
The molecular weight of Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester is 310.02 g/mol.
Where can I buy Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester?
You can request a quote for Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2,4-dichlorophenoxy)-, phenylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.