ethyl N-ethylsulfanylcarbamate
TL;DR: ethyl N-ethylsulfanylcarbamate (CAS 51552-67-1) is a chemical compound with molecular formula C5H11NO2S and molecular weight 149.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-ethylsulfanylcarbamate
Also Known As: ethyl N-ethylsulfanylcarbamate, ethyl ethylthiocarbamate, Ethyl (ethylsulfanyl)carbamate, Butanoic acid,2-carbonyl-3,3-dimethyl-,ethyl ester
| Molecular Formula | C5H11NO2S |
|---|---|
| Molecular Weight | 149.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 149.05106 |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 51552-67-1 |
|---|---|
| SMILES | CCOC(=O)NSCC |
| InChIKey | KJTDPRNOMJXPQM-UHFFFAOYSA-N |
Product Overview
ethyl N-ethylsulfanylcarbamate (CAS 51552-67-1), with molecular formula C5H11NO2S and molecular weight 149.05 g/mol. IUPAC: ethyl N-ethylsulfanylcarbamate.
Chemical Property Profile of ethyl N-ethylsulfanylcarbamate
Property Insights of ethyl N-ethylsulfanylcarbamate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-ethylsulfanylcarbamate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-ethylsulfanylcarbamate. Following Lipinski's Rule of Five, ethyl N-ethylsulfanylcarbamate has 1 hydrogen bond donor(s) and 3 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-ethylsulfanylcarbamate?
The CAS number of ethyl N-ethylsulfanylcarbamate is 51552-67-1.
What is the molecular formula of ethyl N-ethylsulfanylcarbamate?
The molecular formula of ethyl N-ethylsulfanylcarbamate is C5H11NO2S.
What is the molecular weight of ethyl N-ethylsulfanylcarbamate?
The molecular weight of ethyl N-ethylsulfanylcarbamate is 149.05 g/mol.
Where can I buy ethyl N-ethylsulfanylcarbamate?
You can request a quote for ethyl N-ethylsulfanylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-ethylsulfanylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-ethylsulfanylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.