Carbamodithioic acid, 1-naphthalenyl-, methyl ester
TL;DR: Carbamodithioic acid, 1-naphthalenyl-, methyl ester (CAS 13037-43-9) is a chemical compound with molecular formula C12H11NS2 and molecular weight 233.0333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-naphthalen-1-ylcarbamodithioate
Also Known As: Methyl 1-naphthyldithiocarbamate, methyl N-naphthalen-1-ylcarbamodithioate, Methyl 1-naphthalenylcarbamodithioate, Dithio-1-naphthalenecarbamic acid methyl ester, S-Methyl-N-(1-naphthyl)-dithiocarbamat
Technical Specifications
| Molecular Formula | C12H11NS2 |
| Molecular Weight | 233.0333 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.0333 Da |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
| SMILES | CSC(=S)NC1=CC=CC2=CC=CC=C21 |
| InChIKey | AMWMILZYBSFDJC-UHFFFAOYSA-N |
Chemical Property Profile of Carbamodithioic acid, 1-naphthalenyl-, methyl ester
Property Insights of Carbamodithioic acid, 1-naphthalenyl-, methyl ester
The XLogP value of 3.2 indicates that Carbamodithioic acid, 1-naphthalenyl-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamodithioic acid, 1-naphthalenyl-, methyl ester. Following Lipinski's Rule of Five, Carbamodithioic acid, 1-naphthalenyl-, methyl ester 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 Carbamodithioic acid, 1-naphthalenyl-, methyl ester?
The CAS number of Carbamodithioic acid, 1-naphthalenyl-, methyl ester is 13037-43-9.
What is the molecular formula of Carbamodithioic acid, 1-naphthalenyl-, methyl ester?
The molecular formula of Carbamodithioic acid, 1-naphthalenyl-, methyl ester is C12H11NS2.
What is the molecular weight of Carbamodithioic acid, 1-naphthalenyl-, methyl ester?
The molecular weight of Carbamodithioic acid, 1-naphthalenyl-, methyl ester is 233.0333 g/mol.
Where can I buy Carbamodithioic acid, 1-naphthalenyl-, methyl ester?
You can request a quote for Carbamodithioic acid, 1-naphthalenyl-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamodithioic acid, 1-naphthalenyl-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamodithioic acid, 1-naphthalenyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.