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1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane structure
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1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane

TL;DR: 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane (CAS 158721-94-9) is a chemical compound with molecular formula C16H28O3 and molecular weight 268.20386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-methoxy-1-[3-methyl-3-(2-methylbutan-2-ylperoxy)but-1-ynyl]cyclopentane

Also Known As: 1-methoxy-1-[3-methyl-3-(2-methylbutan-2-ylperoxy)but-1-ynyl]cyclopentane, 1-methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane, 1-METHOXY-1-{3-METHYL-3-[(2-METHYLBUTAN-2-YL)PEROXY]BUT-1-YN-1-YL}CYCLOPENTANE

CAS Number
158721-94-9
Molecular Formula
C16H28O3
Molecular Weight
268.20386 g/mol
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Technical Specifications

Molecular FormulaC16H28O3
Molecular Weight268.20386 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)27.7 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds7
Exact Mass268.20386 Da
Heavy Atoms19
Complexity351.0
SMILESCCC(C)(C)OOC(C)(C)C#CC1(CCCC1)OC
InChIKeyICPNRVIJQINFKN-UHFFFAOYSA-N

Chemical Property Profile of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane

XLogP
3.2
TPSA (Topological Polar Surface Area)
27.7
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
7
Heavy Atoms
19
Complexity
351.0
Exact Mass
268.20386
Monoisotopic Mass
268.20386
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane

The XLogP value of 3.2 indicates that 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane 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

What is the CAS number of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane?

The CAS number of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane is 158721-94-9.

What is the molecular formula of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane?

The molecular formula of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane is C16H28O3.

What is the molecular weight of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane?

The molecular weight of 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane is 268.20386 g/mol.

Where can I buy 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane?

You can request a quote for 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane?

Yes, CoreyChem provides custom synthesis services for 1-Methoxy-1-(3-methyl-3-(tert-pentylperoxy)but-1-yn-1-yl)cyclopentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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