Alpha-acetylthiol-3-toluenediazonium
TL;DR: Alpha-acetylthiol-3-toluenediazonium (CAS 36757-49-0) is a chemical compound with molecular formula C9H9N2OS+ and molecular weight 193.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(acetylsulfanylmethyl)benzenediazonium
Also Known As: 3- benzenediazonium, A-acetylthio-m-toluenediazonium, alpha-Acetylthio-3-toluenediazonium, alpha-Acetylthio-m-toluenediazonium, 3-(acetylsulfanylmethyl)benzenediazonium
| Molecular Formula | C9H9N2OS+ |
|---|---|
| Molecular Weight | 193.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.04356 |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 36757-49-0 |
|---|---|
| SMILES | CC(=O)SCC1=CC(=CC=C1)[N+]#N |
| InChIKey | CVBUYVJAYGFRHX-UHFFFAOYSA-N |
Product Overview
Alpha-acetylthiol-3-toluenediazonium (CAS 36757-49-0), with molecular formula C9H9N2OS+ and molecular weight 193.04 g/mol. IUPAC: 3-(acetylsulfanylmethyl)benzenediazonium.
Chemical Property Profile of Alpha-acetylthiol-3-toluenediazonium
Property Insights of Alpha-acetylthiol-3-toluenediazonium
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alpha-acetylthiol-3-toluenediazonium. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Alpha-acetylthiol-3-toluenediazonium. Following Lipinski's Rule of Five, Alpha-acetylthiol-3-toluenediazonium has 0 hydrogen bond donor(s) and 3 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 Alpha-acetylthiol-3-toluenediazonium?
The CAS number of Alpha-acetylthiol-3-toluenediazonium is 36757-49-0.
What is the molecular formula of Alpha-acetylthiol-3-toluenediazonium?
The molecular formula of Alpha-acetylthiol-3-toluenediazonium is C9H9N2OS+.
What is the molecular weight of Alpha-acetylthiol-3-toluenediazonium?
The molecular weight of Alpha-acetylthiol-3-toluenediazonium is 193.04 g/mol.
Where can I buy Alpha-acetylthiol-3-toluenediazonium?
You can request a quote for Alpha-acetylthiol-3-toluenediazonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha-acetylthiol-3-toluenediazonium?
Yes, KEHONG BIO provides custom synthesis services for Alpha-acetylthiol-3-toluenediazonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.