2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate
TL;DR: 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate (CAS 313394-95-5) is a chemical compound with molecular formula C22H18O4 and molecular weight 346.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-1,2-diphenylethyl) 2-hydroxy-3-methylbenzoate
Also Known As: 2-oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate, (2-oxo-1,2-diphenylethyl) 2-hydroxy-3-methylbenzoate
| Molecular Formula | C22H18O4 |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 4.48162 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.1205 |
| Heavy Atoms | 26 |
| Complexity | 917.38696 |
Chemical Identifiers
| CAS Number | 313394-95-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)O |
Product Overview
2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate (CAS 313394-95-5), with molecular formula C22H18O4 and molecular weight 346.12 g/mol. IUPAC: (2-oxo-1,2-diphenylethyl) 2-hydroxy-3-methylbenzoate.
Chemical Property Profile of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate
Property Insights of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate
The XLogP value of 4.48162 indicates that 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate. Following Lipinski's Rule of Five, 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate has 1 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-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate?
The CAS number of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate is 313394-95-5.
What is the molecular formula of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate?
The molecular formula of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate is C22H18O4.
What is the molecular weight of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate?
The molecular weight of 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate is 346.12 g/mol.
Where can I buy 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate?
You can request a quote for 2-Oxo-1,2-diphenylethyl 2-hydroxy-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-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-1,2-diphenylethyl 2-hydroxy-3-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.