![2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone structure](/static/products/5855/585555-53-9.webp)
2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone
TL;DR: 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone (CAS 585555-53-9) is a chemical compound with molecular formula C19H26ClNO2 and molecular weight 335.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone
Also Known As: BAS 12766432, AB01334776-02, 2-[4-(4-chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone, 2-(4-(4-chlorophenyl)-2,2-dimethyltetrahydro-2H-pyran-4-yl)-1-(pyrrolidin-1-yl)ethanone, 2-[4-(4-chlorophenyl)-2,2-dimethyltetrahydro-2H-pyran-4-yl]-1-(pyrrolidin-1-yl)ethanone
| Molecular Formula | C19H26ClNO2 |
|---|---|
| Molecular Weight | 335.17 g/mol |
| LogP | 4.1793 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.1652 |
| Heavy Atoms | 23 |
| Complexity | 563.2373 |
Chemical Identifiers
| CAS Number | 585555-53-9 |
|---|---|
| SMILES | CC1(CC(CCO1)(CC(=O)N2CCCC2)C3=CC=C(C=C3)Cl)C |
Product Overview
2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone (CAS 585555-53-9), with molecular formula C19H26ClNO2 and molecular weight 335.17 g/mol. IUPAC: 2-[4-(4-chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone.
Chemical Property Profile of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone
Property Insights of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone
The XLogP value of 4.1793 indicates that 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone has 0 hydrogen bond donor(s) and 2 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 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone?
The CAS number of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone is 585555-53-9.
What is the molecular formula of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone?
The molecular formula of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone is C19H26ClNO2.
What is the molecular weight of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone?
The molecular weight of 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone is 335.17 g/mol.
Where can I buy 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone?
You can request a quote for 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-Chlorophenyl)-2,2-dimethyloxan-4-yl]-1-pyrrolidin-1-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.