9,12-Octadecadien-1-yl 2-methyl-2-propenoate
TL;DR: 9,12-Octadecadien-1-yl 2-methyl-2-propenoate (CAS 45280-69-1) is a chemical compound with molecular formula C22H38O2 and molecular weight 334.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadeca-9,12-dienyl 2-methylprop-2-enoate
Also Known As: 9,12-octadecadienylmethacrylate, 9,12-Octadecadien-1-yl 2-methyl-2-propenoate, Octadeca-9,12-dien-1-yl 2-methylprop-2-enoate, 2-Propenoic acid,2-methyl-, 9,12-octadecadien-1-yl ester
| Molecular Formula | C22H38O2 |
|---|---|
| Molecular Weight | 334.29 g/mol |
| LogP | 6.9192 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 334.28717 |
| Heavy Atoms | 24 |
| Complexity | 366.1662 |
Chemical Identifiers
| CAS Number | 45280-69-1 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCCOC(=O)C(=C)C |
Product Overview
9,12-Octadecadien-1-yl 2-methyl-2-propenoate (CAS 45280-69-1), with molecular formula C22H38O2 and molecular weight 334.29 g/mol. IUPAC: octadeca-9,12-dienyl 2-methylprop-2-enoate.
Chemical Property Profile of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate
Property Insights of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate
The XLogP value of 6.9192 indicates that 9,12-Octadecadien-1-yl 2-methyl-2-propenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 9,12-Octadecadien-1-yl 2-methyl-2-propenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,12-Octadecadien-1-yl 2-methyl-2-propenoate 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 9,12-Octadecadien-1-yl 2-methyl-2-propenoate?
The CAS number of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate is 45280-69-1.
What is the molecular formula of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate?
The molecular formula of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate is C22H38O2.
What is the molecular weight of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate?
The molecular weight of 9,12-Octadecadien-1-yl 2-methyl-2-propenoate is 334.29 g/mol.
Where can I buy 9,12-Octadecadien-1-yl 2-methyl-2-propenoate?
You can request a quote for 9,12-Octadecadien-1-yl 2-methyl-2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,12-Octadecadien-1-yl 2-methyl-2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for 9,12-Octadecadien-1-yl 2-methyl-2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.