2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate
TL;DR: 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate (CAS 355152-02-2) 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-(2,5-dimethylphenyl)-2-oxoethyl] 4-methylbenzoate
Also Known As: 2-(2,5-dimethylphenyl)-2-oxoethyl 4-methylbenzoate, AB00711828-01, AB00711828-03, [2-(2,5-dimethylphenyl)-2-oxoethyl] 4-methylbenzoate
| Molecular Formula | C18H18O3 |
|---|---|
| Molecular Weight | 282.13 g/mol |
| LogP | 3.65156 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.12558 |
| Heavy Atoms | 21 |
| Complexity | 669.36285 |
Chemical Identifiers
| CAS Number | 355152-02-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC(=O)C2=C(C=CC(=C2)C)C |
Product Overview
2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate (CAS 355152-02-2), with molecular formula C18H18O3 and molecular weight 282.13 g/mol. IUPAC: [2-(2,5-dimethylphenyl)-2-oxoethyl] 4-methylbenzoate.
Chemical Property Profile of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate
Property Insights of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate
The XLogP value of 3.65156 indicates that 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-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-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-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-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate?
The CAS number of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate is 355152-02-2.
What is the molecular formula of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate?
The molecular formula of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate is C18H18O3.
What is the molecular weight of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate?
The molecular weight of 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate is 282.13 g/mol.
Where can I buy 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate?
You can request a quote for 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,5-Dimethylphenyl)-2-oxoethyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.