1-Methyl-3-isopropyltriazene
TL;DR: 1-Methyl-3-isopropyltriazene (CAS 118399-01-2) is a chemical compound with molecular formula C4H11N3 and molecular weight 101.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(methyldiazenyl)propan-2-amine
Also Known As: 1-Methyl-3-isopropyltriazene, N-(methyldiazenyl)propan-2-amine, (1E)-1-Methyl-3-(propan-2-yl)triaz-1-ene, RefChem:231748
| Molecular Formula | C4H11N3 |
|---|---|
| Molecular Weight | 101.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 101.0953 |
| Heavy Atoms | 7 |
| Complexity | 58.0 |
Chemical Identifiers
| CAS Number | 118399-01-2 |
|---|---|
| SMILES | CC(C)NN=NC |
| InChIKey | YLGRFAHAPKIPKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-3-isopropyltriazene (CAS 118399-01-2), with molecular formula C4H11N3 and molecular weight 101.10 g/mol. IUPAC: N-(methyldiazenyl)propan-2-amine.
Chemical Property Profile of 1-Methyl-3-isopropyltriazene
Property Insights of 1-Methyl-3-isopropyltriazene
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-isopropyltriazene. With a topological polar surface area (TPSA) of 36.8 Ų, 1-Methyl-3-isopropyltriazene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-isopropyltriazene 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-Methyl-3-isopropyltriazene?
The CAS number of 1-Methyl-3-isopropyltriazene is 118399-01-2.
What is the molecular formula of 1-Methyl-3-isopropyltriazene?
The molecular formula of 1-Methyl-3-isopropyltriazene is C4H11N3.
What is the molecular weight of 1-Methyl-3-isopropyltriazene?
The molecular weight of 1-Methyl-3-isopropyltriazene is 101.10 g/mol.
Where can I buy 1-Methyl-3-isopropyltriazene?
You can request a quote for 1-Methyl-3-isopropyltriazene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-isopropyltriazene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-isopropyltriazene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.