1-Ethyl-3-methyltriazene
TL;DR: 1-Ethyl-3-methyltriazene (CAS 118398-99-5) is a chemical compound with molecular formula C3H9N3 and molecular weight 87.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(methyldiazenyl)ethanamine
Also Known As: 1-Ethyl-3-methyltriazene, N-(methyldiazenyl)ethanamine, 1-Methyl-3-ethyltriazene, 1-Triazene,3-ethyl-1-methyl-, N-METHYLDIAZENYLETHANAMINE
| Molecular Formula | C3H9N3 |
|---|---|
| Molecular Weight | 87.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 87.07965 |
| Heavy Atoms | 6 |
| Complexity | 41.0 |
Chemical Identifiers
| CAS Number | 118398-99-5 |
|---|---|
| SMILES | CCNN=NC |
| InChIKey | JPDFQGLVHBSJAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethyl-3-methyltriazene (CAS 118398-99-5), with molecular formula C3H9N3 and molecular weight 87.08 g/mol. IUPAC: N-(methyldiazenyl)ethanamine.
Chemical Property Profile of 1-Ethyl-3-methyltriazene
Property Insights of 1-Ethyl-3-methyltriazene
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-3-methyltriazene. With a topological polar surface area (TPSA) of 36.8 Ų, 1-Ethyl-3-methyltriazene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-3-methyltriazene has 1 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 1-Ethyl-3-methyltriazene?
The CAS number of 1-Ethyl-3-methyltriazene is 118398-99-5.
What is the molecular formula of 1-Ethyl-3-methyltriazene?
The molecular formula of 1-Ethyl-3-methyltriazene is C3H9N3.
What is the molecular weight of 1-Ethyl-3-methyltriazene?
The molecular weight of 1-Ethyl-3-methyltriazene is 87.08 g/mol.
Where can I buy 1-Ethyl-3-methyltriazene?
You can request a quote for 1-Ethyl-3-methyltriazene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-3-methyltriazene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-3-methyltriazene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.