(E)-2-Octenyl 2-methyl-(E)-2-butenoate
TL;DR: (E)-2-Octenyl 2-methyl-(E)-2-butenoate (CAS 84271-97-6) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-oct-2-enyl] (E)-2-methylbut-2-enoate
Also Known As: E-2-Octenyl tiglate, 2-Octenyl tiglate, (e)-2-octenyl tiglate, (E)-2-Octenyl 2-methyl-(E)-2-butenoate, WE(8:1(2E)/4:1(2E)(2Me))
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 3.6323 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 226.69044 |
Chemical Identifiers
| CAS Number | 84271-97-6 |
|---|---|
| SMILES | CCCCC/C=C/COC(=O)/C(=C/C)/C |
Product Overview
(E)-2-Octenyl 2-methyl-(E)-2-butenoate (CAS 84271-97-6), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: [(E)-oct-2-enyl] (E)-2-methylbut-2-enoate.
Chemical Property Profile of (E)-2-Octenyl 2-methyl-(E)-2-butenoate
Property Insights of (E)-2-Octenyl 2-methyl-(E)-2-butenoate
The XLogP value of 3.6323 indicates that (E)-2-Octenyl 2-methyl-(E)-2-butenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (E)-2-Octenyl 2-methyl-(E)-2-butenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-Octenyl 2-methyl-(E)-2-butenoate 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 (E)-2-Octenyl 2-methyl-(E)-2-butenoate?
The CAS number of (E)-2-Octenyl 2-methyl-(E)-2-butenoate is 84271-97-6.
What is the molecular formula of (E)-2-Octenyl 2-methyl-(E)-2-butenoate?
The molecular formula of (E)-2-Octenyl 2-methyl-(E)-2-butenoate is C13H22O2.
What is the molecular weight of (E)-2-Octenyl 2-methyl-(E)-2-butenoate?
The molecular weight of (E)-2-Octenyl 2-methyl-(E)-2-butenoate is 210.16 g/mol.
Where can I buy (E)-2-Octenyl 2-methyl-(E)-2-butenoate?
You can request a quote for (E)-2-Octenyl 2-methyl-(E)-2-butenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-Octenyl 2-methyl-(E)-2-butenoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-Octenyl 2-methyl-(E)-2-butenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.