Octahydro-2-methyl-2-azacyclopropa(cd)pentalene
TL;DR: Octahydro-2-methyl-2-azacyclopropa(cd)pentalene (CAS 16967-61-6) is a chemical compound with molecular formula C8H13N and molecular weight 123.1048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-3-azatricyclo[3.3.0.02,8]octane
Also Known As: 2-Methyloctahydro-2-azacyclopropa[cd]pentalene, 3-methyl-3-azatricyclo[3.3.0.02,8]octane, Octahydro-2-methyl-2-azacyclopropa[cd]pentalene, OCTAHYDRO-2-METHYL-2-AZACYCLOPROPA(CD)PENTALENE, 2-Azacyclopropa[cd]pentalene, octahydro-2-methyl-
Technical Specifications
| Molecular Formula | C8H13N |
| Molecular Weight | 123.1048 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 123.1048 Da |
| Heavy Atoms | 9 |
| Complexity | 155.0 |
| SMILES | CN1CC2CCC3C2C31 |
| InChIKey | RDPVUZMOVZHRHV-UHFFFAOYSA-N |
Chemical Property Profile of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene
Property Insights of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octahydro-2-methyl-2-azacyclopropa(cd)pentalene. With a topological polar surface area (TPSA) of 3.2 Ų, Octahydro-2-methyl-2-azacyclopropa(cd)pentalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octahydro-2-methyl-2-azacyclopropa(cd)pentalene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene?
The CAS number of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene is 16967-61-6.
What is the molecular formula of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene?
The molecular formula of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene is C8H13N.
What is the molecular weight of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene?
The molecular weight of Octahydro-2-methyl-2-azacyclopropa(cd)pentalene is 123.1048 g/mol.
Where can I buy Octahydro-2-methyl-2-azacyclopropa(cd)pentalene?
You can request a quote for Octahydro-2-methyl-2-azacyclopropa(cd)pentalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Octahydro-2-methyl-2-azacyclopropa(cd)pentalene?
Yes, CoreyChem provides custom synthesis services for Octahydro-2-methyl-2-azacyclopropa(cd)pentalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.