(2R)-1-(azepan-1-yl)-2-chloropropan-1-one
TL;DR: (2R)-1-(azepan-1-yl)-2-chloropropan-1-one (CAS 115840-34-1) is a chemical compound with molecular formula C9H16ClNO and molecular weight 189.09204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-1-(azepan-1-yl)-2-chloropropan-1-one
Also Known As: 1-(2-chloropropanoyl)azepane
Technical Specifications
| Molecular Formula | C9H16ClNO |
| Molecular Weight | 189.09204 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.09204 Da |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
| SMILES | C[C@H](C(=O)N1CCCCCC1)Cl |
| InChIKey | FZICYJAARJPVGH-MRVPVSSYSA-N |
Chemical Property Profile of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one
Property Insights of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R)-1-(azepan-1-yl)-2-chloropropan-1-one. With a topological polar surface area (TPSA) of 20.3 Ų, (2R)-1-(azepan-1-yl)-2-chloropropan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2R)-1-(azepan-1-yl)-2-chloropropan-1-one 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 (2R)-1-(azepan-1-yl)-2-chloropropan-1-one?
The CAS number of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one is 115840-34-1.
What is the molecular formula of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one?
The molecular formula of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one is C9H16ClNO.
What is the molecular weight of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one?
The molecular weight of (2R)-1-(azepan-1-yl)-2-chloropropan-1-one is 189.09204 g/mol.
Where can I buy (2R)-1-(azepan-1-yl)-2-chloropropan-1-one?
You can request a quote for (2R)-1-(azepan-1-yl)-2-chloropropan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2R)-1-(azepan-1-yl)-2-chloropropan-1-one?
Yes, CoreyChem provides custom synthesis services for (2R)-1-(azepan-1-yl)-2-chloropropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.