3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate
TL;DR: 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate (CAS 92376-36-8) is a chemical compound with molecular formula C51H100O6S and molecular weight 840.72 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hexadecanoyloxy-3-hexadecylsulfonylpropyl) hexadecanoate
Also Known As: 3-(hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate, (2-hexadecanoyloxy-3-hexadecylsulfonylpropyl) hexadecanoate, 3-(Hexadecane-1-sulfonyl)propane-1,2-diyl dihexadecanoate
| Molecular Formula | C51H100O6S |
|---|---|
| Molecular Weight | 840.72 g/mol |
| LogP | 21.9 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 50 |
| Exact Mass | 840.72406 |
| Heavy Atoms | 58 |
| Complexity | 961.0 |
Chemical Identifiers
| CAS Number | 92376-36-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCS(=O)(=O)CC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | QDEOCYNQXJCISM-UHFFFAOYSA-N |
Product Overview
3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate (CAS 92376-36-8), with molecular formula C51H100O6S and molecular weight 840.72 g/mol. IUPAC: (2-hexadecanoyloxy-3-hexadecylsulfonylpropyl) hexadecanoate.
Chemical Property Profile of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate
Property Insights of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate
The XLogP value of 21.9 indicates that 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate. Following Lipinski's Rule of Five, 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate 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 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate?
The CAS number of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate is 92376-36-8.
What is the molecular formula of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate?
The molecular formula of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate is C51H100O6S.
What is the molecular weight of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate?
The molecular weight of 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate is 840.72 g/mol.
Where can I buy 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate?
You can request a quote for 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Hexadecylsulfonyl)propane-1,2-diyl dihexadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.