ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
TL;DR: ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate (CAS 55808-21-4) is a chemical compound with molecular formula C10H16N2O3 and molecular weight 212.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
Also Known As: ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate, ethyl 5-tert-butyl-3-isoxazolylcarbamate, Ethyl (5-(tert-butyl)isoxazol-3-yl)carbamate, ethyl (5-tert-butyl-1,2-oxazol-3-yl)carbamate, ethyl (5-tert-butyl-3-isoxazolyl)carbamate
| Molecular Formula | C10H16N2O3 |
|---|---|
| Molecular Weight | 212.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.11609 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 55808-21-4 |
|---|---|
| SMILES | CCOC(=O)NC1=NOC(=C1)C(C)(C)C |
| InChIKey | QUCROCXEJQRURH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate (CAS 55808-21-4), with molecular formula C10H16N2O3 and molecular weight 212.12 g/mol. IUPAC: ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate.
Chemical Property Profile of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
Property Insights of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate. Following Lipinski's Rule of Five, ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate 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 ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate?
The CAS number of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate is 55808-21-4.
What is the molecular formula of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate?
The molecular formula of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate is C10H16N2O3.
What is the molecular weight of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate?
The molecular weight of ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate is 212.12 g/mol.
Where can I buy ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate?
You can request a quote for ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)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-(5-tert-butyl-1,2-oxazol-3-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.