Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester
TL;DR: Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester (CAS 126560-42-7) is a chemical compound with molecular formula C6H11NOS2 and molecular weight 177.02821 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-(2-ethenoxyethyl)carbamodithioate
Also Known As: Methyl (2-(ethenyloxy)ethyl)carbamodithioate, Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester, methyl N-(2-ethenoxyethyl)carbamodithioate, Methyl [2-(ethenyloxy)ethyl]carbamodithioate, BRN 3537042
Technical Specifications
| Molecular Formula | C6H11NOS2 |
| Molecular Weight | 177.02821 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 78.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 177.02821 Da |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
| SMILES | CSC(=S)NCCOC=C |
| InChIKey | YQDJHSCKNKBRSF-UHFFFAOYSA-N |
Chemical Property Profile of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester
Property Insights of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester. The TPSA of 78.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester. Following Lipinski's Rule of Five, Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl 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)-, methyl ester?
The CAS number of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester is 126560-42-7.
What is the molecular formula of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester?
The molecular formula of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester is C6H11NOS2.
What is the molecular weight of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester?
The molecular weight of Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester is 177.02821 g/mol.
Where can I buy Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester?
You can request a quote for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl 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)-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamodithioic acid, (2-(ethenyloxy)ethyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.