3,7-dimethylocta-1,6-dien-3-yl Dodecanoate
TL;DR: 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate (CAS 38585-61-4) is a chemical compound with molecular formula C22H40O2 and molecular weight 336.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethylocta-1,6-dien-3-yl dodecanoate
Also Known As: Linalyl-laurate, 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate, Lauric acid, 1,5-dimethyl-1-vinyl-4-hexenyl ester
| Molecular Formula | C22H40O2 |
|---|---|
| Molecular Weight | 336.30 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 336.30283 |
| Heavy Atoms | 24 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 38585-61-4 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)OC(C)(CCC=C(C)C)C=C |
| InChIKey | PDZXXPUFGDUCMY-UHFFFAOYSA-N |
Product Overview
3,7-dimethylocta-1,6-dien-3-yl Dodecanoate (CAS 38585-61-4), with molecular formula C22H40O2 and molecular weight 336.30 g/mol. IUPAC: 3,7-dimethylocta-1,6-dien-3-yl dodecanoate.
Chemical Property Profile of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate
Property Insights of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate
The XLogP value of 8.5 indicates that 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate?
The CAS number of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate is 38585-61-4.
What is the molecular formula of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate?
The molecular formula of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate is C22H40O2.
What is the molecular weight of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate?
The molecular weight of 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate is 336.30 g/mol.
Where can I buy 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate?
You can request a quote for 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate?
Yes, KEHONG BIO provides custom synthesis services for 3,7-dimethylocta-1,6-dien-3-yl Dodecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.