N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide
TL;DR: N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide (CAS 95-31-8) is a chemical compound with molecular formula C11H14N2S2 and molecular weight 238.05984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine
Also Known As: N-tert-Butyl-2-benzothiazolesulfenamide, Santocure NS, Nocceler NS, Vulkacit NZ, Pennac Tbbs
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H14N2S2 |
| Molecular Weight | 238.05984 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.05984 Da |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
| Melting Point | 104 °C (MIN) |
| Density | 1.29 @ 25 °C |
| Solubility | SOL IN MOST ORG SOLVENTS |
| SMILES | CC(C)(C)NSC1=NC2=CC=CC=C2S1 |
| InChIKey | IUJLOAKJZQBENM-UHFFFAOYSA-N |
Product Description
Applications: N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide is used in polymer chemistry and functional materials synthesis, as well as polymer additives and plastics compounding. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide (CAS 95-31-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A polymer intermediate supplied by CoreyChem, N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide (CAS 95-31-8) has the molecular formula C11H14N2S2 and a molecular weight of 238.06 g/mol. Reported properties include a density of 1.29 @ 25 °C g/cm³, a solubility: SOL IN MOST ORG SOLVENTS. It is also known as N-tert-Butyl-2-benzothiazolesulfenamide and Santocure NS.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide
Property Insights of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide
The XLogP value of 3.4 indicates that N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide. Following Lipinski's Rule of Five, N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide?
The CAS number of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide is 95-31-8.
What is the molecular formula of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide?
The molecular formula of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide is C11H14N2S2.
What is the molecular weight of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide?
The molecular weight of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide is 238.05984 g/mol.
What are the applications of N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide?
N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide is used in polymer chemistry and functional materials synthesis, as well as polymer additives and plastics compounding. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide?
You can request a quote for N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide?
Yes, CoreyChem provides custom synthesis services for N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.