1-(2-Chlorobenzoyl)pyrrolidine
TL;DR: 1-(2-Chlorobenzoyl)pyrrolidine (CAS 70657-66-8) is a chemical compound with molecular formula C11H12ClNO and molecular weight 209.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)-pyrrolidin-1-ylmethanone
Also Known As: 1-(2-chlorobenzoyl)pyrrolidine, (2-chlorophenyl)-pyrrolidin-1-ylmethanone, (2-chlorophenyl)(pyrrolidin-1-yl)methanone, 2-chlorophenyl pyrrolidinyl ketone, 4-(N-maleimidophenyl) glycidylether
| Molecular Formula | C11H12ClNO |
|---|---|
| Molecular Weight | 209.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.06075 |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 70657-66-8 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC=CC=C2Cl |
| InChIKey | GJOSCESYZNHDFC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Chlorobenzoyl)pyrrolidine (CAS 70657-66-8), with molecular formula C11H12ClNO and molecular weight 209.06 g/mol. IUPAC: (2-chlorophenyl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of 1-(2-Chlorobenzoyl)pyrrolidine
Property Insights of 1-(2-Chlorobenzoyl)pyrrolidine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chlorobenzoyl)pyrrolidine. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(2-Chlorobenzoyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chlorobenzoyl)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
Frequently Asked Questions
What is the CAS number of 1-(2-Chlorobenzoyl)pyrrolidine?
The CAS number of 1-(2-Chlorobenzoyl)pyrrolidine is 70657-66-8.
What is the molecular formula of 1-(2-Chlorobenzoyl)pyrrolidine?
The molecular formula of 1-(2-Chlorobenzoyl)pyrrolidine is C11H12ClNO.
What is the molecular weight of 1-(2-Chlorobenzoyl)pyrrolidine?
The molecular weight of 1-(2-Chlorobenzoyl)pyrrolidine is 209.06 g/mol.
Where can I buy 1-(2-Chlorobenzoyl)pyrrolidine?
You can request a quote for 1-(2-Chlorobenzoyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chlorobenzoyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chlorobenzoyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.