O-nonyl N-ethylcarbamothioate
TL;DR: O-nonyl N-ethylcarbamothioate (CAS 120904-30-5) is a chemical compound with molecular formula C12H25NOS and molecular weight 231.16568 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
O-nonyl N-ethylcarbamothioate
Also Known As: O-nonyl N-ethylcarbamothioate, O-Nonyl ethylcarbamothioate, N-ethyl-1-nonoxy-methanethioamide, Carbamothioic acid,ethyl-, O-nonyl ester (9CI), Carbamothioic acid,ethyl-,O-nonyl ester (9CI)
Technical Specifications
| Molecular Formula | C12H25NOS |
| Molecular Weight | 231.16568 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 53.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 231.16568 Da |
| Heavy Atoms | 15 |
| Complexity | 151.0 |
| SMILES | CCCCCCCCCOC(=S)NCC |
| InChIKey | PASNELXFAZOGPW-UHFFFAOYSA-N |
Chemical Property Profile of O-nonyl N-ethylcarbamothioate
Property Insights of O-nonyl N-ethylcarbamothioate
The XLogP value of 4.9 indicates that O-nonyl N-ethylcarbamothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.4 Ų, O-nonyl N-ethylcarbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-nonyl 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
What is the CAS number of O-nonyl N-ethylcarbamothioate?
The CAS number of O-nonyl N-ethylcarbamothioate is 120904-30-5.
What is the molecular formula of O-nonyl N-ethylcarbamothioate?
The molecular formula of O-nonyl N-ethylcarbamothioate is C12H25NOS.
What is the molecular weight of O-nonyl N-ethylcarbamothioate?
The molecular weight of O-nonyl N-ethylcarbamothioate is 231.16568 g/mol.
Where can I buy O-nonyl N-ethylcarbamothioate?
You can request a quote for O-nonyl N-ethylcarbamothioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for O-nonyl N-ethylcarbamothioate?
Yes, CoreyChem provides custom synthesis services for O-nonyl N-ethylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.