4-(2-Acetoxyacetyl)phenyl acetate
TL;DR: 4-(2-Acetoxyacetyl)phenyl acetate (CAS 42528-99-4) is a chemical compound with molecular formula C12H12O5 and molecular weight 236.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-acetyloxyphenyl)-2-oxoethyl] acetate
Also Known As: 4-(2-Acetoxyacetyl)phenyl acetate, 4- PHENYLACETATE, 2,4'-diacetoxyacetophenone, EINECS 255-870-6, [2-(4-acetyloxyphenyl)-2-oxoethyl] acetate
| Molecular Formula | C12H12O5 |
|---|---|
| Molecular Weight | 236.07 g/mol |
| LogP | 1.3577 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.06847 |
| Heavy Atoms | 17 |
| Complexity | 432.71414 |
Chemical Identifiers
| CAS Number | 42528-99-4 |
|---|---|
| SMILES | CC(=O)OCC(=O)C1=CC=C(C=C1)OC(=O)C |
Product Overview
4-(2-Acetoxyacetyl)phenyl acetate (CAS 42528-99-4), with molecular formula C12H12O5 and molecular weight 236.07 g/mol. IUPAC: [2-(4-acetyloxyphenyl)-2-oxoethyl] acetate.
Chemical Property Profile of 4-(2-Acetoxyacetyl)phenyl acetate
Property Insights of 4-(2-Acetoxyacetyl)phenyl acetate
The XLogP value of 1.3577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Acetoxyacetyl)phenyl acetate. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Acetoxyacetyl)phenyl acetate. Following Lipinski's Rule of Five, 4-(2-Acetoxyacetyl)phenyl acetate has 0 hydrogen bond donor(s) and 5 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 4-(2-Acetoxyacetyl)phenyl acetate?
The CAS number of 4-(2-Acetoxyacetyl)phenyl acetate is 42528-99-4.
What is the molecular formula of 4-(2-Acetoxyacetyl)phenyl acetate?
The molecular formula of 4-(2-Acetoxyacetyl)phenyl acetate is C12H12O5.
What is the molecular weight of 4-(2-Acetoxyacetyl)phenyl acetate?
The molecular weight of 4-(2-Acetoxyacetyl)phenyl acetate is 236.07 g/mol.
Where can I buy 4-(2-Acetoxyacetyl)phenyl acetate?
You can request a quote for 4-(2-Acetoxyacetyl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Acetoxyacetyl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Acetoxyacetyl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.