2-Oxo-2-phenylethyl 4-aminobenzoate
TL;DR: 2-Oxo-2-phenylethyl 4-aminobenzoate (CAS 107692-58-0) is a chemical compound with molecular formula C15H13NO3 and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 4-aminobenzoate
Also Known As: phenacyl 4-aminobenzoate, 2-oxo-2-phenylethyl 4-aminobenzoate, 4-Amino-benzoic acid 2-oxo-2-phenyl-ethyl ester, phenacyl p-aminobenzoate, BAS 00928164
| Molecular Formula | C15H13NO3 |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.08954 |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 107692-58-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N |
| InChIKey | DCACVDCJUZSHPS-UHFFFAOYSA-N |
Product Overview
2-Oxo-2-phenylethyl 4-aminobenzoate (CAS 107692-58-0), with molecular formula C15H13NO3 and molecular weight 255.09 g/mol. IUPAC: phenacyl 4-aminobenzoate.
Chemical Property Profile of 2-Oxo-2-phenylethyl 4-aminobenzoate
Property Insights of 2-Oxo-2-phenylethyl 4-aminobenzoate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-2-phenylethyl 4-aminobenzoate. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxo-2-phenylethyl 4-aminobenzoate. Following Lipinski's Rule of Five, 2-Oxo-2-phenylethyl 4-aminobenzoate 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-2-phenylethyl 4-aminobenzoate?
The CAS number of 2-Oxo-2-phenylethyl 4-aminobenzoate is 107692-58-0.
What is the molecular formula of 2-Oxo-2-phenylethyl 4-aminobenzoate?
The molecular formula of 2-Oxo-2-phenylethyl 4-aminobenzoate is C15H13NO3.
What is the molecular weight of 2-Oxo-2-phenylethyl 4-aminobenzoate?
The molecular weight of 2-Oxo-2-phenylethyl 4-aminobenzoate is 255.09 g/mol.
Where can I buy 2-Oxo-2-phenylethyl 4-aminobenzoate?
You can request a quote for 2-Oxo-2-phenylethyl 4-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-2-phenylethyl 4-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-phenylethyl 4-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.