![[1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate structure](/static/products/6281/6281-11-4.webp)
[1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate
TL;DR: [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate (CAS 6281-11-4) is a chemical compound with molecular formula C15H25NO2 and molecular weight 251.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate
Also Known As: [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate|1-(Dimethylamino)-5-ethylhept-2-yn-4-yl (2E)-but-2-enoate
| Molecular Formula | C15H25NO2 |
|---|---|
| Molecular Weight | 251.19 g/mol |
| LogP | 2.4755 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.18852 |
| Heavy Atoms | 18 |
| Complexity | 319.12064 |
Chemical Identifiers
| CAS Number | 6281-11-4 |
|---|---|
| SMILES | CCC(CC)C(C#CCN(C)C)OC(=O)/C=C/C |
Product Overview
[1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate (CAS 6281-11-4), with molecular formula C15H25NO2 and molecular weight 251.19 g/mol. IUPAC: [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate.
Chemical Property Profile of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate
Property Insights of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate
The XLogP value of 2.4755 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate. With a topological polar surface area (TPSA) of 29.54 Ų, [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate 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-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate?
The CAS number of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate is 6281-11-4.
What is the molecular formula of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate?
The molecular formula of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate is C15H25NO2.
What is the molecular weight of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate?
The molecular weight of [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate is 251.19 g/mol.
Where can I buy [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate?
You can request a quote for [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for [1-(dimethylamino)-5-ethylhept-2-yn-4-yl] (E)-but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.