1-(Chloroacetyl)pyrrolidine
TL;DR: 1-(Chloroacetyl)pyrrolidine (CAS 20266-00-6) is a chemical compound with molecular formula C6H10ClNO and molecular weight 147.04509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-1-pyrrolidin-1-ylethanone
Also Known As: 1-(Chloroacetyl)pyrrolidine, 2-chloro-1-(pyrrolidin-1-yl)ethanone, 2-Chloro-1-pyrrolidin-1-yl-ethanone, Pyrrolidine, 1-(chloroacetyl)-, Cinepazide Impurity 6
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H10ClNO |
| Molecular Weight | 147.04509 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.04509 Da |
| Heavy Atoms | 9 |
| Complexity | 110.0 |
| SMILES | C1CCN(C1)C(=O)CCl |
| InChIKey | AAOSLLBWWRKJIR-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Chloroacetyl)pyrrolidine
Property Insights of 1-(Chloroacetyl)pyrrolidine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Chloroacetyl)pyrrolidine. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(Chloroacetyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Chloroacetyl)pyrrolidine 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 1-(Chloroacetyl)pyrrolidine?
The CAS number of 1-(Chloroacetyl)pyrrolidine is 20266-00-6.
What is the molecular formula of 1-(Chloroacetyl)pyrrolidine?
The molecular formula of 1-(Chloroacetyl)pyrrolidine is C6H10ClNO.
What is the molecular weight of 1-(Chloroacetyl)pyrrolidine?
The molecular weight of 1-(Chloroacetyl)pyrrolidine is 147.04509 g/mol.
Where can I buy 1-(Chloroacetyl)pyrrolidine?
You can request a quote for 1-(Chloroacetyl)pyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Chloroacetyl)pyrrolidine?
Yes, CoreyChem provides custom synthesis services for 1-(Chloroacetyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.