2-Chlorobenzyl diphenylacetate
TL;DR: 2-Chlorobenzyl diphenylacetate (CAS 479355-77-6) is a chemical compound with molecular formula C21H17ClO2 and molecular weight 336.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)methyl 2,2-diphenylacetate
Also Known As: 2-chlorobenzyl diphenylacetate, 2-CHLOROBENZYL 2,2-DIPHENYLACETATE, (2-chlorophenyl)methyl 2,2-diphenylacetate
| Molecular Formula | C21H17ClO2 |
|---|---|
| Molecular Weight | 336.09 g/mol |
| LogP | 5.2153 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.0917 |
| Heavy Atoms | 24 |
| Complexity | 760.83734 |
Chemical Identifiers
| CAS Number | 479355-77-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3Cl |
Product Overview
2-Chlorobenzyl diphenylacetate (CAS 479355-77-6), with molecular formula C21H17ClO2 and molecular weight 336.09 g/mol. IUPAC: (2-chlorophenyl)methyl 2,2-diphenylacetate.
Chemical Property Profile of 2-Chlorobenzyl diphenylacetate
Property Insights of 2-Chlorobenzyl diphenylacetate
The XLogP value of 5.2153 indicates that 2-Chlorobenzyl diphenylacetate 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-Chlorobenzyl diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorobenzyl diphenylacetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chlorobenzyl diphenylacetate?
The CAS number of 2-Chlorobenzyl diphenylacetate is 479355-77-6.
What is the molecular formula of 2-Chlorobenzyl diphenylacetate?
The molecular formula of 2-Chlorobenzyl diphenylacetate is C21H17ClO2.
What is the molecular weight of 2-Chlorobenzyl diphenylacetate?
The molecular weight of 2-Chlorobenzyl diphenylacetate is 336.09 g/mol.
Where can I buy 2-Chlorobenzyl diphenylacetate?
You can request a quote for 2-Chlorobenzyl diphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorobenzyl diphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorobenzyl diphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.