3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate
TL;DR: 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate (CAS 84006-23-5) is a chemical compound with molecular formula C40H70O4 and molecular weight 614.53 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate
Also Known As: 2,3-Butanediol bis(9,12-octadecadienoate), 1,2-Dimethyl-1,2-ethanediyl 9,12-octadecadienoate, 9,12-Octadecadienoic acid, 1,2-dimethyl-1,2-ethanediyl ester, 9,12-Octadecadienoicacid, 1,2-dimethyl-1,2-ethanediyl ester (9CI)
| Molecular Formula | C40H70O4 |
|---|---|
| Molecular Weight | 614.53 g/mol |
| LogP | 12.4768 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 31 |
| Exact Mass | 614.5274 |
| Heavy Atoms | 44 |
| Complexity | 699.3379 |
Chemical Identifiers
| CAS Number | 84006-23-5 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCC(=O)OC(C)C(C)OC(=O)CCCCCCCC=CCC=CCCCCC |
Product Overview
3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate (CAS 84006-23-5), with molecular formula C40H70O4 and molecular weight 614.53 g/mol. IUPAC: 3-octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate.
Chemical Property Profile of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate
Property Insights of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate
The XLogP value of 12.4768 indicates that 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate has 0 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 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate?
The CAS number of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate is 84006-23-5.
What is the molecular formula of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate?
The molecular formula of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate is C40H70O4.
What is the molecular weight of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate?
The molecular weight of 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate is 614.53 g/mol.
Where can I buy 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate?
You can request a quote for 3-Octadeca-9,12-dienoyloxybutan-2-yl 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 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Octadeca-9,12-dienoyloxybutan-2-yl octadeca-9,12-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.