Benzyl dimethyldithiocarbamate
TL;DR: Benzyl dimethyldithiocarbamate (CAS 7250-18-2) is a chemical compound with molecular formula C10H13NS2 and molecular weight 211.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N,N-dimethylcarbamodithioate
Also Known As: Benzyl dimethyldithiocarbamate, Benzyl-N,N-dimethyldithiocarbamate, benzyl dimethylcarbamodithioate, benzyl N,N-dimethylcarbamodithioate, BENZYL N,N-DIMETHYLDITHIOCARBAMATE
| Molecular Formula | C10H13NS2 |
|---|---|
| Molecular Weight | 211.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 60.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.04893 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 7250-18-2 |
|---|---|
| SMILES | CN(C)C(=S)SCC1=CC=CC=C1 |
| InChIKey | HLZBIKHKXIJIHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl dimethyldithiocarbamate (CAS 7250-18-2), with molecular formula C10H13NS2 and molecular weight 211.05 g/mol. IUPAC: benzyl N,N-dimethylcarbamodithioate.
Chemical Property Profile of Benzyl dimethyldithiocarbamate
Property Insights of Benzyl dimethyldithiocarbamate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl dimethyldithiocarbamate. The TPSA of 60.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl dimethyldithiocarbamate. Following Lipinski's Rule of Five, Benzyl dimethyldithiocarbamate has 0 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 Benzyl dimethyldithiocarbamate?
The CAS number of Benzyl dimethyldithiocarbamate is 7250-18-2.
What is the molecular formula of Benzyl dimethyldithiocarbamate?
The molecular formula of Benzyl dimethyldithiocarbamate is C10H13NS2.
What is the molecular weight of Benzyl dimethyldithiocarbamate?
The molecular weight of Benzyl dimethyldithiocarbamate is 211.05 g/mol.
Where can I buy Benzyl dimethyldithiocarbamate?
You can request a quote for Benzyl dimethyldithiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl dimethyldithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl dimethyldithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.