(2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate
TL;DR: (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate (CAS 80995-98-8) is a chemical compound with molecular formula C53H100O5S and molecular weight 848.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate
Also Known As: Dotd-tgo, 1,2-dioleoyl-3-S-tetradecyl-3-thioglycerolS-oxide, 1,2-Dioleoyl-3-S-tetradecyl-3-thioglycerol S-oxide, 1,2-Dioleoyl-3-S-tetradecyl-3-thio-sn-glycerol S-oxide, rac-1,2-Dioleoyl-3-S-tetradecyl-3-thioglycerol S-oxide
| Molecular Formula | C53H100O5S |
|---|---|
| Molecular Weight | 848.73 g/mol |
| LogP | 20.7 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 50 |
| Exact Mass | 848.7291 |
| Heavy Atoms | 59 |
| Complexity | 962.0 |
Chemical Identifiers
| CAS Number | 80995-98-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCS(=O)CC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC |
| InChIKey | ROYVFLOUYRVIPH-UHFFFAOYSA-N |
Product Overview
(2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate (CAS 80995-98-8), with molecular formula C53H100O5S and molecular weight 848.73 g/mol. IUPAC: (2-octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate.
Chemical Property Profile of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate
Property Insights of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate
The XLogP value of 20.7 indicates that (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate. Following Lipinski's Rule of Five, (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate?
The CAS number of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate is 80995-98-8.
What is the molecular formula of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate?
The molecular formula of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate is C53H100O5S.
What is the molecular weight of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate?
The molecular weight of (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate is 848.73 g/mol.
Where can I buy (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate?
You can request a quote for (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Octadec-9-enoyloxy-3-tetradecylsulfinylpropyl) octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.