O-(1-Methylethyl) N-ethylcarbamothioate
TL;DR: O-(1-Methylethyl) N-ethylcarbamothioate (CAS 141-98-0) is a chemical compound with molecular formula C6H13NOS and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-propan-2-yl N-ethylcarbamothioate
Also Known As: O-Isopropyl ethylthiocarbamate, Aluminum subacetate, O-Isopropyl N-ethylthiocarbamate, Dow Z-200, O-propan-2-yl N-ethylcarbamothioate
| Molecular Formula | C6H13NOS |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 1.3058 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 147.0718 |
| Heavy Atoms | 9 |
| Complexity | 93.05865 |
Chemical Identifiers
| CAS Number | 141-98-0 |
|---|---|
| SMILES | CCNC(=S)OC(C)C |
Product Overview
O-(1-Methylethyl) N-ethylcarbamothioate (CAS 141-98-0), with molecular formula C6H13NOS and molecular weight 147.07 g/mol. IUPAC: O-propan-2-yl N-ethylcarbamothioate.
Chemical Property Profile of O-(1-Methylethyl) N-ethylcarbamothioate
Property Insights of O-(1-Methylethyl) N-ethylcarbamothioate
The XLogP value of 1.3058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-(1-Methylethyl) N-ethylcarbamothioate. With a topological polar surface area (TPSA) of 21.26 Ų, O-(1-Methylethyl) N-ethylcarbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-(1-Methylethyl) N-ethylcarbamothioate has 1 hydrogen bond donor(s) and 2 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 O-(1-Methylethyl) N-ethylcarbamothioate?
The CAS number of O-(1-Methylethyl) N-ethylcarbamothioate is 141-98-0.
What is the molecular formula of O-(1-Methylethyl) N-ethylcarbamothioate?
The molecular formula of O-(1-Methylethyl) N-ethylcarbamothioate is C6H13NOS.
What is the molecular weight of O-(1-Methylethyl) N-ethylcarbamothioate?
The molecular weight of O-(1-Methylethyl) N-ethylcarbamothioate is 147.07 g/mol.
Where can I buy O-(1-Methylethyl) N-ethylcarbamothioate?
You can request a quote for O-(1-Methylethyl) N-ethylcarbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-(1-Methylethyl) N-ethylcarbamothioate?
Yes, KEHONG BIO provides custom synthesis services for O-(1-Methylethyl) N-ethylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.