Ethyl (E)-2-decen-4-ynoate
TL;DR: Ethyl (E)-2-decen-4-ynoate (CAS 66901-42-6) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-dec-2-en-4-ynoate
Also Known As: Ethyl (E)-2-decen-4-ynoate, ethyl -2-decen-4-ynoate, EINECS 266-514-4, ethyl (2E)-2-decen-4-ynoate, ethyl (E)-dec-2-en-4-ynoate
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.6894 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 230.44162 |
Chemical Identifiers
| CAS Number | 66901-42-6 |
|---|---|
| SMILES | CCCCCC#C/C=C/C(=O)OCC |
Product Overview
Ethyl (E)-2-decen-4-ynoate (CAS 66901-42-6), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: ethyl (E)-dec-2-en-4-ynoate.
Chemical Property Profile of Ethyl (E)-2-decen-4-ynoate
Property Insights of Ethyl (E)-2-decen-4-ynoate
The XLogP value of 2.6894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (E)-2-decen-4-ynoate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl (E)-2-decen-4-ynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (E)-2-decen-4-ynoate 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 Ethyl (E)-2-decen-4-ynoate?
The CAS number of Ethyl (E)-2-decen-4-ynoate is 66901-42-6.
What is the molecular formula of Ethyl (E)-2-decen-4-ynoate?
The molecular formula of Ethyl (E)-2-decen-4-ynoate is C12H18O2.
What is the molecular weight of Ethyl (E)-2-decen-4-ynoate?
The molecular weight of Ethyl (E)-2-decen-4-ynoate is 194.13 g/mol.
Where can I buy Ethyl (E)-2-decen-4-ynoate?
You can request a quote for Ethyl (E)-2-decen-4-ynoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (E)-2-decen-4-ynoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (E)-2-decen-4-ynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.