ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate
TL;DR: ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate (CAS 303095-07-0) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(1-hydroxy-2-oxo-2-thiophen-2-ylethyl)carbamate
Also Known As: BAS 02234644, BIM-0002503.P001, ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate, ethyl 1-hydroxy-2-oxo-2-(2-thienyl)ethylcarbamate, ethyl 1-hydroxy-2-oxo-2-thien-2-ylethylcarbamate
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 303095-07-0 |
|---|---|
| SMILES | CCOC(=O)NC(C(=O)C1=CC=CS1)O |
| InChIKey | XFMPOFKLOCBDKF-UHFFFAOYSA-N |
Product Overview
ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate (CAS 303095-07-0), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: ethyl N-(1-hydroxy-2-oxo-2-thiophen-2-ylethyl)carbamate.
Chemical Property Profile of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate
Property Insights of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate. Following Lipinski's Rule of Five, ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate has 2 hydrogen bond donor(s) and 5 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 N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate?
The CAS number of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate is 303095-07-0.
What is the molecular formula of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate?
The molecular formula of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate is C9H11NO4S.
What is the molecular weight of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate?
The molecular weight of ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate is 229.04 g/mol.
Where can I buy ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate?
You can request a quote for ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[1-hydroxy-2-oxo-2-(thiophen-2-yl)ethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.