![[(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate structure](/static/products/744/74499-47-1.png)
[(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate
TL;DR: [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate (CAS 74499-47-1) is a chemical compound with molecular formula C16H28O2 and molecular weight 252.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate
Also Known As: 2-Butenoic acid, 3-methyl-, (3E)-3,7-dimethyl-3,6-octadienyl ester, [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate, 2-Butenoic acid, 3-methyl-, (3E)-3,7-dimethyl-3,6-octadien-1-yl ester
| Molecular Formula | C16H28O2 |
|---|---|
| Molecular Weight | 252.21 g/mol |
| LogP | 4.5144 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 252.20892 |
| Heavy Atoms | 18 |
| Complexity | 307.05865 |
Chemical Identifiers
| CAS Number | 74499-47-1 |
|---|---|
| SMILES | C[C@@H](C(C)C)C(=O)OCC/C(=C/CC=C(C)C)/C |
Product Overview
[(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate (CAS 74499-47-1), with molecular formula C16H28O2 and molecular weight 252.21 g/mol. IUPAC: [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate.
Chemical Property Profile of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate
Property Insights of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate
The XLogP value of 4.5144 indicates that [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate 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 [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate?
The CAS number of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate is 74499-47-1.
What is the molecular formula of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate?
The molecular formula of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate is C16H28O2.
What is the molecular weight of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate?
The molecular weight of [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate is 252.21 g/mol.
Where can I buy [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate?
You can request a quote for [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for [(3E)-3,7-dimethylocta-3,6-dienyl] (2S)-2,3-dimethylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.