Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester
TL;DR: Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester (CAS 126560-46-1) is a chemical compound with molecular formula C9H17NOS2 and molecular weight 219.07515 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl N-(2-ethenoxyethyl)carbamodithioate
Also Known As: Butyl (2-(ethenyloxy)ethyl)carbamodithioate, Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester, butyl N-(2-ethenoxyethyl)carbamodithioate, Butyl [2-(ethenyloxy)ethyl]carbamodithioate, BRN 3539490
Technical Specifications
| Molecular Formula | C9H17NOS2 |
| Molecular Weight | 219.07515 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 78.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 219.07515 Da |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
| SMILES | CCCCSC(=S)NCCOC=C |
| InChIKey | MJKRQBMGILXIMF-UHFFFAOYSA-N |
Chemical Property Profile of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester
Property Insights of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester. The TPSA of 78.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester. Following Lipinski's Rule of Five, Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester 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
What is the CAS number of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester?
The CAS number of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester is 126560-46-1.
What is the molecular formula of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester?
The molecular formula of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester is C9H17NOS2.
What is the molecular weight of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester?
The molecular weight of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester is 219.07515 g/mol.
Where can I buy Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester?
You can request a quote for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, butyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.