ethyl N-(2-methylpropoxycarbothioyl)carbamate
TL;DR: ethyl N-(2-methylpropoxycarbothioyl)carbamate (CAS 103122-66-3) is a chemical compound with molecular formula C8H15NO3S and molecular weight 205.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(2-methylpropoxycarbothioyl)carbamate
Also Known As: ethyl N-(2-methylpropoxycarbothioyl)carbamate, o-Isobutyl-N-ethoxy carbonylthiocarbamate, Carbamic acid, ((2-methylpropoxy)thioxomethyl)-, ethyl ester, EC 434-350-4, Aethoxycarbonyl-isobutoxythiocarbonyl-amin
| Molecular Formula | C8H15NO3S |
|---|---|
| Molecular Weight | 205.08 g/mol |
| LogP | 1.69 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.07727 |
| Heavy Atoms | 13 |
| Complexity | 182.22795 |
Chemical Identifiers
| CAS Number | 103122-66-3 |
|---|---|
| SMILES | CCOC(=O)NC(=S)OCC(C)C |
Product Overview
ethyl N-(2-methylpropoxycarbothioyl)carbamate (CAS 103122-66-3), with molecular formula C8H15NO3S and molecular weight 205.08 g/mol. IUPAC: ethyl N-(2-methylpropoxycarbothioyl)carbamate.
Chemical Property Profile of ethyl N-(2-methylpropoxycarbothioyl)carbamate
Property Insights of ethyl N-(2-methylpropoxycarbothioyl)carbamate
The XLogP value of 1.69 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-(2-methylpropoxycarbothioyl)carbamate. With a topological polar surface area (TPSA) of 47.56 Ų, ethyl N-(2-methylpropoxycarbothioyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-(2-methylpropoxycarbothioyl)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-(2-methylpropoxycarbothioyl)carbamate?
The CAS number of ethyl N-(2-methylpropoxycarbothioyl)carbamate is 103122-66-3.
What is the molecular formula of ethyl N-(2-methylpropoxycarbothioyl)carbamate?
The molecular formula of ethyl N-(2-methylpropoxycarbothioyl)carbamate is C8H15NO3S.
What is the molecular weight of ethyl N-(2-methylpropoxycarbothioyl)carbamate?
The molecular weight of ethyl N-(2-methylpropoxycarbothioyl)carbamate is 205.08 g/mol.
Where can I buy ethyl N-(2-methylpropoxycarbothioyl)carbamate?
You can request a quote for ethyl N-(2-methylpropoxycarbothioyl)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-(2-methylpropoxycarbothioyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-(2-methylpropoxycarbothioyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.