Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate
TL;DR: Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate (CAS 88636-91-3) is a chemical compound with molecular formula C12H13NO4 and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-oxo-1,3-oxazolidin-3-yl)benzoate
Also Known As: Ethyl 4-(2-oxo-1,3-oxazolidin-3-yl)benzoate, Ethyl p-(2-oxo-3-oxazolidinyl)benzoate, ethyl 4-(2-oxooxazolidin-3-yl)benzoate, ethyl 4-(-2-oxooxazolidin-3-yl)benzoate, 4-(2-Oxooxazolidin-3-yl)benzoic acid ethyl ester
| Molecular Formula | C12H13NO4 |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.08446 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 88636-91-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2CCOC2=O |
| InChIKey | VNPLELOQBRAOPK-UHFFFAOYSA-N |
Product Overview
Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate (CAS 88636-91-3), with molecular formula C12H13NO4 and molecular weight 235.08 g/mol. IUPAC: ethyl 4-(2-oxo-1,3-oxazolidin-3-yl)benzoate.
Chemical Property Profile of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate
Property Insights of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate. With a topological polar surface area (TPSA) of 55.8 Ų, Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate 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 Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate?
The CAS number of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate is 88636-91-3.
What is the molecular formula of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate?
The molecular formula of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate is C12H13NO4.
What is the molecular weight of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate?
The molecular weight of Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate is 235.08 g/mol.
Where can I buy Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate?
You can request a quote for Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl p-(2-oxo-1,3-oxazolidin-3-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.