二甲硫基甲苯二胺
TL;DR: 二甲硫基甲苯二胺 (CAS 104983-85-9) is a chemical compound with molecular formula C9H14N2S2 and molecular weight 214.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二甲硫基甲苯二胺
2-methyl-4,6-bis(methylsulfanyl)benzene-1,3-diamine
Also Known As: Ethacure 300, 3,5-dimethylthio-2,6-diaminotoluene, Dimethyl thio-toluene diamine, dimethylthiotoluenediamine, Dimethylthiotoluene diamine DMTDA
| Molecular Formula | C9H14N2S2 |
|---|---|
| Molecular Weight | 214.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.05984 |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 104983-85-9 |
|---|---|
| SMILES | CC1=C(C(=CC(=C1N)SC)SC)N |
| InChIKey | TXDBDYPHJXUHEO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二甲硫基甲苯二胺 (CAS 104983-85-9), with molecular formula C9H14N2S2 and molecular weight 214.06 g/mol. IUPAC: 2-methyl-4,6-bis(methylsulfanyl)benzene-1,3-diamine.
Chemical Property Profile of 二甲硫基甲苯二胺
Property Insights of 二甲硫基甲苯二胺
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二甲硫基甲苯二胺. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 二甲硫基甲苯二胺. Following Lipinski's Rule of Five, 二甲硫基甲苯二胺 has 2 hydrogen bond donor(s) and 4 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 二甲硫基甲苯二胺?
The CAS number of 二甲硫基甲苯二胺 is 104983-85-9.
What is the molecular formula of 二甲硫基甲苯二胺?
The molecular formula of 二甲硫基甲苯二胺 is C9H14N2S2.
What is the molecular weight of 二甲硫基甲苯二胺?
The molecular weight of 二甲硫基甲苯二胺 is 214.06 g/mol.
Where can I buy 二甲硫基甲苯二胺?
You can request a quote for 二甲硫基甲苯二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二甲硫基甲苯二胺?
Yes, KEHONG BIO provides custom synthesis services for 二甲硫基甲苯二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.