2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate
TL;DR: 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate (CAS 524042-91-9) is a chemical compound with molecular formula C18H18O3 and molecular weight 282.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-ethylphenyl)-2-oxoethyl] 3-methylbenzoate
Also Known As: 2-(4-ethylphenyl)-2-oxoethyl 3-methylbenzoate, [2-(4-ethylphenyl)-2-oxoethyl] 3-methylbenzoate
| Molecular Formula | C18H18O3 |
|---|---|
| Molecular Weight | 282.13 g/mol |
| LogP | 3.59712 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.12558 |
| Heavy Atoms | 21 |
| Complexity | 641.76794 |
Chemical Identifiers
| CAS Number | 524042-91-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC(=C2)C |
Product Overview
2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate (CAS 524042-91-9), with molecular formula C18H18O3 and molecular weight 282.13 g/mol. IUPAC: [2-(4-ethylphenyl)-2-oxoethyl] 3-methylbenzoate.
Chemical Property Profile of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate
Property Insights of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate
The XLogP value of 3.59712 indicates that 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate 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 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate?
The CAS number of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate is 524042-91-9.
What is the molecular formula of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate?
The molecular formula of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate is C18H18O3.
What is the molecular weight of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate?
The molecular weight of 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate is 282.13 g/mol.
Where can I buy 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate?
You can request a quote for 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Ethylphenyl)-2-oxoethyl 3-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.