Octadeca-9,12-dienoic acid;octadec-9-enoic acid
TL;DR: Octadeca-9,12-dienoic acid;octadec-9-enoic acid (CAS 84789-96-8) is a chemical compound with molecular formula C36H66O4 and molecular weight 562.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadeca-9,12-dienoic acid;octadec-9-enoic acid
Also Known As: (9Z,12Z)-octadeca-9,12-dienoic acid; (Z)-octadec-9-enoic acid
| Molecular Formula | C36H66O4 |
|---|---|
| Molecular Weight | 562.50 g/mol |
| LogP | 11.993 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 29 |
| Exact Mass | 562.4961 |
| Heavy Atoms | 40 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 84789-96-8 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)O.CCCCCC=CCC=CCCCCCCCC(=O)O |
| InChIKey | ONRGCKHNIPGJGT-UHFFFAOYSA-N |
Product Overview
Octadeca-9,12-dienoic acid;octadec-9-enoic acid (CAS 84789-96-8), with molecular formula C36H66O4 and molecular weight 562.50 g/mol. IUPAC: octadeca-9,12-dienoic acid;octadec-9-enoic acid.
Chemical Property Profile of Octadeca-9,12-dienoic acid;octadec-9-enoic acid
Property Insights of Octadeca-9,12-dienoic acid;octadec-9-enoic acid
The XLogP value of 11.993 indicates that Octadeca-9,12-dienoic acid;octadec-9-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Octadeca-9,12-dienoic acid;octadec-9-enoic acid. Following Lipinski's Rule of Five, Octadeca-9,12-dienoic acid;octadec-9-enoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octadeca-9,12-dienoic acid;octadec-9-enoic acid?
The CAS number of Octadeca-9,12-dienoic acid;octadec-9-enoic acid is 84789-96-8.
What is the molecular formula of Octadeca-9,12-dienoic acid;octadec-9-enoic acid?
The molecular formula of Octadeca-9,12-dienoic acid;octadec-9-enoic acid is C36H66O4.
What is the molecular weight of Octadeca-9,12-dienoic acid;octadec-9-enoic acid?
The molecular weight of Octadeca-9,12-dienoic acid;octadec-9-enoic acid is 562.50 g/mol.
Where can I buy Octadeca-9,12-dienoic acid;octadec-9-enoic acid?
You can request a quote for Octadeca-9,12-dienoic acid;octadec-9-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadeca-9,12-dienoic acid;octadec-9-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for Octadeca-9,12-dienoic acid;octadec-9-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.