2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate
TL;DR: 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate (CAS 444076-44-2) is a chemical compound with molecular formula C20H33NO2 and molecular weight 319.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,5,9-tetramethyldeca-3,4,8-trienyl 2-pyrrolidin-1-ylacetate
Also Known As: 2,2,5,9-tetramethyldeca-3,4,8-trienyl 2-pyrrolidin-1-ylacetate, 2,2,5,9-tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate, 2,2,5,9-tetramethyldeca-3,4,8-trien-1-yl 2-(pyrrolidin-1-yl)acetate
| Molecular Formula | C20H33NO2 |
|---|---|
| Molecular Weight | 319.25 g/mol |
| LogP | 4.4994 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 319.25113 |
| Heavy Atoms | 23 |
| Complexity | 471.87015 |
Chemical Identifiers
| CAS Number | 444076-44-2 |
|---|---|
| SMILES | CC(=CCCC(=C=CC(C)(C)COC(=O)CN1CCCC1)C)C |
Product Overview
2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate (CAS 444076-44-2), with molecular formula C20H33NO2 and molecular weight 319.25 g/mol. IUPAC: 2,2,5,9-tetramethyldeca-3,4,8-trienyl 2-pyrrolidin-1-ylacetate.
Chemical Property Profile of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate
Property Insights of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate
The XLogP value of 4.4994 indicates that 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate 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 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate?
The CAS number of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate is 444076-44-2.
What is the molecular formula of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate?
The molecular formula of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate is C20H33NO2.
What is the molecular weight of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate?
The molecular weight of 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate is 319.25 g/mol.
Where can I buy 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate?
You can request a quote for 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,5,9-Tetramethyldeca-3,4,8-trien-1-yl pyrrolidin-1-ylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.