Isooctadecanoic acid, ester with 1,2,3-propanetriol
TL;DR: Isooctadecanoic acid, ester with 1,2,3-propanetriol (CAS 61332-02-3) is a chemical compound with molecular formula C21H44O5 and molecular weight 376.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-methylheptadecanoic acid;propane-1,2,3-triol
Also Known As: EINECS 262-710-9, Isooctadecanoic acid, ester with 1,2,3-propanetriol, 16-methylheptadecanoic acid;propane-1,2,3-triol, GLYCERYL ISOSTEARATE (UNSPECIFIED RATIO), 16-methylheptadecanoic acid,propane-1,2,3-triol
| Molecular Formula | C21H44O5 |
|---|---|
| Molecular Weight | 376.32 g/mol |
| LogP | 4.5203 |
| Topological Polar Surface Area | 97.99 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 376.31888 |
| Heavy Atoms | 26 |
| Complexity | 277.575 |
Chemical Identifiers
| CAS Number | 61332-02-3 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCCCCCC(=O)O.C(C(CO)O)O |
Product Overview
Isooctadecanoic acid, ester with 1,2,3-propanetriol (CAS 61332-02-3), with molecular formula C21H44O5 and molecular weight 376.32 g/mol. IUPAC: 16-methylheptadecanoic acid;propane-1,2,3-triol.
Chemical Property Profile of Isooctadecanoic acid, ester with 1,2,3-propanetriol
Property Insights of Isooctadecanoic acid, ester with 1,2,3-propanetriol
The XLogP value of 4.5203 indicates that Isooctadecanoic acid, ester with 1,2,3-propanetriol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Isooctadecanoic acid, ester with 1,2,3-propanetriol. Following Lipinski's Rule of Five, Isooctadecanoic acid, ester with 1,2,3-propanetriol has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isooctadecanoic acid, ester with 1,2,3-propanetriol?
The CAS number of Isooctadecanoic acid, ester with 1,2,3-propanetriol is 61332-02-3.
What is the molecular formula of Isooctadecanoic acid, ester with 1,2,3-propanetriol?
The molecular formula of Isooctadecanoic acid, ester with 1,2,3-propanetriol is C21H44O5.
What is the molecular weight of Isooctadecanoic acid, ester with 1,2,3-propanetriol?
The molecular weight of Isooctadecanoic acid, ester with 1,2,3-propanetriol is 376.32 g/mol.
Where can I buy Isooctadecanoic acid, ester with 1,2,3-propanetriol?
You can request a quote for Isooctadecanoic acid, ester with 1,2,3-propanetriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isooctadecanoic acid, ester with 1,2,3-propanetriol?
Yes, KEHONG BIO provides custom synthesis services for Isooctadecanoic acid, ester with 1,2,3-propanetriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.