1-(2-Chloro-5-nitrobenzoyl)pyrrolidine
TL;DR: 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine (CAS 333346-19-3) is a chemical compound with molecular formula C11H11ClN2O3 and molecular weight 254.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-5-nitrophenyl)-pyrrolidin-1-ylmethanone
Also Known As: 1-(2-chloro-5-nitrobenzoyl)pyrrolidine, (2-chloro-5-nitrophenyl)(pyrrolidin-1-yl)methanone, 1-{2-chloro-5-nitrobenzoyl}pyrrolidine, (2-chloro-5-nitrophenyl)-pyrrolidin-1-ylmethanone, BAS 00783232
| Molecular Formula | C11H11ClN2O3 |
|---|---|
| Molecular Weight | 254.05 g/mol |
| LogP | 2.4842 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.04582 |
| Heavy Atoms | 17 |
| Complexity | 469.7844 |
Chemical Identifiers
| CAS Number | 333346-19-3 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl |
Product Overview
1-(2-Chloro-5-nitrobenzoyl)pyrrolidine (CAS 333346-19-3), with molecular formula C11H11ClN2O3 and molecular weight 254.05 g/mol. IUPAC: (2-chloro-5-nitrophenyl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine
Property Insights of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine
The XLogP value of 2.4842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine. Following Lipinski's Rule of Five, 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine has 0 hydrogen bond donor(s) and 3 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-Chloro-5-nitrobenzoyl)pyrrolidine?
The CAS number of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine is 333346-19-3.
What is the molecular formula of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine?
The molecular formula of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine is C11H11ClN2O3.
What is the molecular weight of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine?
The molecular weight of 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine is 254.05 g/mol.
Where can I buy 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine?
You can request a quote for 1-(2-Chloro-5-nitrobenzoyl)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-Chloro-5-nitrobenzoyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloro-5-nitrobenzoyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.