13-过氧羟基十八碳-9,11,15-三烯酸
TL;DR: 13-过氧羟基十八碳-9,11,15-三烯酸 (CAS 62554-20-5) is a chemical compound with molecular formula C18H30O4 and molecular weight 310.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-过氧羟基十八碳-9,11,15-三烯酸
13-hydroperoxyoctadeca-9,11,15-trienoic acid
Also Known As: 13(S)-HpOTrE, 13-Hpot, 13-Hydroperoxy-9,11,15-octadecatrienoic acid, 13-hydroperoxyoctadeca-9,11,15-trienoic acid, 9,11,15-Octadecatrienoic acid, 13-hydroperoxy-, (Z,Z,Z)-
| Molecular Formula | C18H30O4 |
|---|---|
| Molecular Weight | 310.21 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 310.21442 |
| Heavy Atoms | 22 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 62554-20-5 |
|---|---|
| SMILES | CCC=CCC(C=CC=CCCCCCCCC(=O)O)OO |
| InChIKey | UYQGVDXDXBAABN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
13-过氧羟基十八碳-9,11,15-三烯酸 (CAS 62554-20-5), with molecular formula C18H30O4 and molecular weight 310.21 g/mol. IUPAC: 13-hydroperoxyoctadeca-9,11,15-trienoic acid.
Chemical Property Profile of 13-过氧羟基十八碳-9,11,15-三烯酸
Property Insights of 13-过氧羟基十八碳-9,11,15-三烯酸
The XLogP value of 4.8 indicates that 13-过氧羟基十八碳-9,11,15-三烯酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 13-过氧羟基十八碳-9,11,15-三烯酸. Following Lipinski's Rule of Five, 13-过氧羟基十八碳-9,11,15-三烯酸 has 2 hydrogen bond donor(s) and 4 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 13-过氧羟基十八碳-9,11,15-三烯酸?
The CAS number of 13-过氧羟基十八碳-9,11,15-三烯酸 is 62554-20-5.
What is the molecular formula of 13-过氧羟基十八碳-9,11,15-三烯酸?
The molecular formula of 13-过氧羟基十八碳-9,11,15-三烯酸 is C18H30O4.
What is the molecular weight of 13-过氧羟基十八碳-9,11,15-三烯酸?
The molecular weight of 13-过氧羟基十八碳-9,11,15-三烯酸 is 310.21 g/mol.
Where can I buy 13-过氧羟基十八碳-9,11,15-三烯酸?
You can request a quote for 13-过氧羟基十八碳-9,11,15-三烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13-过氧羟基十八碳-9,11,15-三烯酸?
Yes, KEHONG BIO provides custom synthesis services for 13-过氧羟基十八碳-9,11,15-三烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.