2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate
TL;DR: 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate (CAS 313394-86-4) is a chemical compound with molecular formula C18H18O4 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethylphenyl)-2-oxoethyl] 2-methoxybenzoate
Also Known As: 2-(3,4-dimethylphenyl)-2-oxoethyl 2-methoxybenzoate, [2-(3,4-dimethylphenyl)-2-oxoethyl] 2-methoxybenzoate
| Molecular Formula | C18H18O4 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 3.35174 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.1205 |
| Heavy Atoms | 22 |
| Complexity | 703.9834 |
Chemical Identifiers
| CAS Number | 313394-86-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2OC)C |
Product Overview
2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate (CAS 313394-86-4), with molecular formula C18H18O4 and molecular weight 298.12 g/mol. IUPAC: [2-(3,4-dimethylphenyl)-2-oxoethyl] 2-methoxybenzoate.
Chemical Property Profile of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate
Property Insights of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate
The XLogP value of 3.35174 indicates that 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate has 0 hydrogen bond donor(s) and 4 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-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate?
The CAS number of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate is 313394-86-4.
What is the molecular formula of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate?
The molecular formula of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate is C18H18O4.
What is the molecular weight of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate?
The molecular weight of 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate is 298.12 g/mol.
Where can I buy 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate?
You can request a quote for 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.