![Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate structure](/static/products/806/80661-26-3.png)
Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate
TL;DR: Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate (CAS 80661-26-3) is a chemical compound with molecular formula C22H19ClO3 and molecular weight 366.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(3-chloro-4-phenylmethoxyphenyl)acetate
Also Known As: benzyl 2-(3-chloro-4-phenylmethoxyphenyl)acetate, benzyl [4-(benzyloxy)-3-chlorophenyl]acetate, benzyl 2-(4-(benzyloxy)-3-chlorophenyl)acetate, Benzyl 2-(3-chloro-4-phenylmethoxy-phenyl)acetate
| Molecular Formula | C22H19ClO3 |
|---|---|
| Molecular Weight | 366.10 g/mol |
| LogP | 5.2049 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 366.10226 |
| Heavy Atoms | 26 |
| Complexity | 847.77606 |
Chemical Identifiers
| CAS Number | 80661-26-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)CC(=O)OCC3=CC=CC=C3)Cl |
Product Overview
Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate (CAS 80661-26-3), with molecular formula C22H19ClO3 and molecular weight 366.10 g/mol. IUPAC: benzyl 2-(3-chloro-4-phenylmethoxyphenyl)acetate.
Chemical Property Profile of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate
Property Insights of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate
The XLogP value of 5.2049 indicates that Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate?
The CAS number of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate is 80661-26-3.
What is the molecular formula of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate?
The molecular formula of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate is C22H19ClO3.
What is the molecular weight of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate?
The molecular weight of Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate is 366.10 g/mol.
Where can I buy Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate?
You can request a quote for Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl [4-(benzyloxy)-3-chlorophenyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.