(1S,4R)-2-azabicyclo(2.2.1)heptan-3-one
TL;DR: (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one (CAS 134003-03-5) is a chemical compound with molecular formula C6H9NO and molecular weight 111.06841 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,4R)-2-azabicyclo[2.2.1]heptan-3-one
Also Known As: (1S,4R)-2-AZABICYCLO[2.2.1]HEPTAN-3-ONE, 2-Azabicyclo[2.2.1]hept-2-en-3-ol, (1s,4r)-2-azabicyclo(2.2.1)heptan-3-one, -2-AZABICYCLO[2.2.1]HEPTAN-3-ONE, J2.654.328B
Technical Specifications
| Molecular Formula | C6H9NO |
| Molecular Weight | 111.06841 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.06841 Da |
| Heavy Atoms | 8 |
| Complexity | 132.0 |
| SMILES | C1C[C@H]2C[C@@H]1C(=O)N2 |
| InChIKey | UIVLZOWDXYXITH-UHNVWZDZSA-N |
Chemical Property Profile of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one
Property Insights of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one. With a topological polar surface area (TPSA) of 29.1 Ų, (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one has 1 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 (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one?
The CAS number of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one is 134003-03-5.
What is the molecular formula of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one?
The molecular formula of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one is C6H9NO.
What is the molecular weight of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one?
The molecular weight of (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one is 111.06841 g/mol.
Where can I buy (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one?
You can request a quote for (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one?
Yes, CoreyChem provides custom synthesis services for (1S,4R)-2-azabicyclo(2.2.1)heptan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.