Linalyl oleate
TL;DR: Linalyl oleate (CAS 31796-73-3) is a chemical compound with molecular formula C28H50O2 and molecular weight 418.38 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 (Z)-octadec-9-enoate
Also Known As: linalyl oleate, Linalyl-oleate, Oleic acid linalyl ester, 3,7-dimethylocta-1,6-dien-3-yl (Z)-octadec-9-enoate, Oleic acid, 1,5-dimethyl-1-vinyl-4-hexenyl ester
| Molecular Formula | C28H50O2 |
|---|---|
| Molecular Weight | 418.38 g/mol |
| LogP | 9.2582 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 20 |
| Exact Mass | 418.38107 |
| Heavy Atoms | 30 |
| Complexity | 484.86755 |
Chemical Identifiers
| CAS Number | 31796-73-3 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC(C)(CCC=C(C)C)C=C |
Product Overview
Linalyl oleate (CAS 31796-73-3), with molecular formula C28H50O2 and molecular weight 418.38 g/mol. IUPAC: 3,7-dimethylocta-1,6-dien-3-yl (Z)-octadec-9-enoate.
Chemical Property Profile of Linalyl oleate
Property Insights of Linalyl oleate
The XLogP value of 9.2582 indicates that Linalyl oleate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Linalyl oleate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Linalyl oleate 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 Linalyl oleate?
The CAS number of Linalyl oleate is 31796-73-3.
What is the molecular formula of Linalyl oleate?
The molecular formula of Linalyl oleate is C28H50O2.
What is the molecular weight of Linalyl oleate?
The molecular weight of Linalyl oleate is 418.38 g/mol.
Where can I buy Linalyl oleate?
You can request a quote for Linalyl oleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Linalyl oleate?
Yes, KEHONG BIO provides custom synthesis services for Linalyl oleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.