1-(3,4-Dichlorobenzoyl)pyrrolidine
TL;DR: 1-(3,4-Dichlorobenzoyl)pyrrolidine (CAS 33763-95-0) is a chemical compound with molecular formula C11H11Cl2NO and molecular weight 243.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorophenyl)-pyrrolidin-1-ylmethanone
Also Known As: 1-(3,4-dichlorobenzoyl)pyrrolidine, 3,4-dichlorophenyl pyrrolidinyl ketone, BAS 00783712, (3,4-dichlorophenyl)-pyrrolidin-1-ylmethanone, (3,4-Dichloro-phenyl)-pyrrolidin-1-yl-methanone
| Molecular Formula | C11H11Cl2NO |
|---|---|
| Molecular Weight | 243.02 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.02177 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 33763-95-0 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl |
| InChIKey | XQWRTAOXCSSTBB-UHFFFAOYSA-N |
Product Overview
1-(3,4-Dichlorobenzoyl)pyrrolidine (CAS 33763-95-0), with molecular formula C11H11Cl2NO and molecular weight 243.02 g/mol. IUPAC: (3,4-dichlorophenyl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of 1-(3,4-Dichlorobenzoyl)pyrrolidine
Property Insights of 1-(3,4-Dichlorobenzoyl)pyrrolidine
The XLogP value of 3.9 indicates that 1-(3,4-Dichlorobenzoyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(3,4-Dichlorobenzoyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dichlorobenzoyl)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-(3,4-Dichlorobenzoyl)pyrrolidine?
The CAS number of 1-(3,4-Dichlorobenzoyl)pyrrolidine is 33763-95-0.
What is the molecular formula of 1-(3,4-Dichlorobenzoyl)pyrrolidine?
The molecular formula of 1-(3,4-Dichlorobenzoyl)pyrrolidine is C11H11Cl2NO.
What is the molecular weight of 1-(3,4-Dichlorobenzoyl)pyrrolidine?
The molecular weight of 1-(3,4-Dichlorobenzoyl)pyrrolidine is 243.02 g/mol.
Where can I buy 1-(3,4-Dichlorobenzoyl)pyrrolidine?
You can request a quote for 1-(3,4-Dichlorobenzoyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dichlorobenzoyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorobenzoyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.