(2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate
TL;DR: (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate (CAS 13397-95-0) is a chemical compound with molecular formula C39H69O8P and molecular weight 696.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate
Also Known As: (2-octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate, 2,3-dianil of 2',5'-dichloro-2,3-dioxo-butyranilide, 1-[(PHOSPHONOOXY)METHYL]ETHANE-1,2-DIYL BIS[(9Z,12Z)-OCTADECA-9,12-DIENOATE], [2-[(9E,12E)-Octadeca-9,12-dienoyl]oxy-3-phosphonooxypropyl] (9E,12E)-octadeca-9,12-dienoate, 1-((Phosphonooxy)methyl)ethane-1,2-diyl bis((9Z,12Z)-octadeca-9,12-dienoate)
| Molecular Formula | C39H69O8P |
|---|---|
| Molecular Weight | 696.47 g/mol |
| LogP | 11.9 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 36 |
| Exact Mass | 696.473 |
| Heavy Atoms | 48 |
| Complexity | 921.0 |
Chemical Identifiers
| CAS Number | 13397-95-0 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCC=CCC=CCCCCC |
| InChIKey | OBXRDFNCKFWKNY-UHFFFAOYSA-N |
Product Overview
(2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate (CAS 13397-95-0), with molecular formula C39H69O8P and molecular weight 696.47 g/mol. IUPAC: (2-octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate.
Chemical Property Profile of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate
Property Insights of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate
The XLogP value of 11.9 indicates that (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate. Following Lipinski's Rule of Five, (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate?
The CAS number of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate is 13397-95-0.
What is the molecular formula of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate?
The molecular formula of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate is C39H69O8P.
What is the molecular weight of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate?
The molecular weight of (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate is 696.47 g/mol.
Where can I buy (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate?
You can request a quote for (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Octadeca-9,12-dienoyloxy-3-phosphonooxypropyl) octadeca-9,12-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.