2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-
TL;DR: 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- (CAS 66343-91-7) is a chemical compound with molecular formula C7H12N2 and molecular weight 124.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2,3-diazabicyclo[2.2.2]oct-2-ene
Also Known As: 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-, 4-methyl-2,3-diazabicyclo[2.2.2]oct-2-ene, 1-Methyl-2,3-diazabicyclo<2.2.2>octen, 2,3-Diazabicyclo[2.2.2]oct-2-ene,1-methyl-, 2,3-Diazabicyclo[2.2.2]oct-2-ene, 1-methyl-
| Molecular Formula | C7H12N2 |
|---|---|
| Molecular Weight | 124.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.10005 |
| Heavy Atoms | 9 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 66343-91-7 |
|---|---|
| SMILES | CC12CCC(CC1)N=N2 |
| InChIKey | LXFPVYRCXCVOHN-UHFFFAOYSA-N |
Product Overview
2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- (CAS 66343-91-7), with molecular formula C7H12N2 and molecular weight 124.10 g/mol. IUPAC: 1-methyl-2,3-diazabicyclo[2.2.2]oct-2-ene.
Chemical Property Profile of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-
Property Insights of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-. With a topological polar surface area (TPSA) of 24.7 Ų, 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- 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 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-?
The CAS number of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- is 66343-91-7.
What is the molecular formula of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-?
The molecular formula of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- is C7H12N2.
What is the molecular weight of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-?
The molecular weight of 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- is 124.10 g/mol.
Where can I buy 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-?
You can request a quote for 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Diazabicyclo(2.2.2)oct-2-ene, 1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.