1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene
TL;DR: 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene (CAS 49570-30-1) is a chemical compound with molecular formula C8H14N2 and molecular weight 138.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyl-2,3-diazabicyclo[2.2.2]oct-2-ene
Also Known As: Me2DBO, 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene, 1,4-dimethyl-2,3-diazabicyclo[2.2.2]oct-2-ene, 2,3-Diazabicyclo[2.2.2]oct-2-ene,1,4-dimethyl-, 1,4-Dimethyl-2,3-diaza-bicyclo[2.2.2]oct-2-ene
| Molecular Formula | C8H14N2 |
|---|---|
| Molecular Weight | 138.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.11569 |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 49570-30-1 |
|---|---|
| SMILES | CC12CCC(CC1)(N=N2)C |
| InChIKey | HNKORYYGGBIIGK-UHFFFAOYSA-N |
Product Overview
1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene (CAS 49570-30-1), with molecular formula C8H14N2 and molecular weight 138.12 g/mol. IUPAC: 1,4-dimethyl-2,3-diazabicyclo[2.2.2]oct-2-ene.
Chemical Property Profile of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene
Property Insights of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene. With a topological polar surface area (TPSA) of 24.7 Ų, 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene has 0 hydrogen bond donor(s) and 2 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 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene?
The CAS number of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene is 49570-30-1.
What is the molecular formula of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene?
The molecular formula of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene is C8H14N2.
What is the molecular weight of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene?
The molecular weight of 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene is 138.12 g/mol.
Where can I buy 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene?
You can request a quote for 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethyl-2,3-diaza-bicyclo(2.2.2)oct-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.