单硬脂酸甘油酯
TL;DR: 单硬脂酸甘油酯 (CAS 123-94-4) is a chemical compound with molecular formula C21H42O4 and molecular weight 358.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
单硬脂酸甘油酯
2,3-dihydroxypropyl octadecanoate
Also Known As: Glyceryl monostearate, Monostearin, Glyceryl stearate, Tegin, 1-Stearoyl-rac-glycerol
| Molecular Formula | C21H42O4 |
|---|---|
| Molecular Weight | 358.31 g/mol |
| LogP | 7.4 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 358.30832 |
| Heavy Atoms | 25 |
| Complexity | 281.0 |
| Density | 0.97 @25 °C |
| Solubility | insoluble in water; soluble in hot oils, organic solvents |
Chemical Identifiers
| CAS Number | 123-94-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O |
| InChIKey | VBICKXHEKHSIBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
单硬脂酸甘油酯 (CAS 123-94-4), with molecular formula C21H42O4 and molecular weight 358.31 g/mol. IUPAC: 2,3-dihydroxypropyl octadecanoate.
Chemical Property Profile of 单硬脂酸甘油酯
Property Insights of 单硬脂酸甘油酯
The XLogP value of 7.4 indicates that 单硬脂酸甘油酯 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 单硬脂酸甘油酯. Following Lipinski's Rule of Five, 单硬脂酸甘油酯 has 2 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 单硬脂酸甘油酯?
The CAS number of 单硬脂酸甘油酯 is 123-94-4.
What is the molecular formula of 单硬脂酸甘油酯?
The molecular formula of 单硬脂酸甘油酯 is C21H42O4.
What is the molecular weight of 单硬脂酸甘油酯?
The molecular weight of 单硬脂酸甘油酯 is 358.31 g/mol.
Where can I buy 单硬脂酸甘油酯?
You can request a quote for 单硬脂酸甘油酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 单硬脂酸甘油酯?
Yes, KEHONG BIO provides custom synthesis services for 单硬脂酸甘油酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.