(2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate
TL;DR: (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate (CAS 56599-88-3) is a chemical compound with molecular formula C28H46O4 and molecular weight 446.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-phenyl-1,3-dioxolan-4-yl)methyl octadecanoate
Also Known As: (2-phenyl-1,3-dioxolan-4-yl)methyl octadecanoate, (2-Phenyl-1,3-dioxolan-4-yl)methyl stearate, Stearic acid (2-phenyl-1,3-dioxolan-4-yl)methyl ester, Octadecanoic acid, (2-phenyl-1,3-dioxolan-4-yl)methyl ester, cis-, Octadecanoic acid, (2-phenyl-1,3-dioxolan-4-yl)methyl ester
| Molecular Formula | C28H46O4 |
|---|---|
| Molecular Weight | 446.34 g/mol |
| LogP | 9.7 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 446.3396 |
| Heavy Atoms | 32 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 56599-88-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC1COC(O1)C2=CC=CC=C2 |
| InChIKey | FGJHAWILWLBPSG-UHFFFAOYSA-N |
Product Overview
(2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate (CAS 56599-88-3), with molecular formula C28H46O4 and molecular weight 446.34 g/mol. IUPAC: (2-phenyl-1,3-dioxolan-4-yl)methyl octadecanoate.
Chemical Property Profile of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate
Property Insights of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate
The XLogP value of 9.7 indicates that (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate 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 (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate?
The CAS number of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate is 56599-88-3.
What is the molecular formula of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate?
The molecular formula of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate is C28H46O4.
What is the molecular weight of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate?
The molecular weight of (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate is 446.34 g/mol.
Where can I buy (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate?
You can request a quote for (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Phenyl-1,3-dioxolan-4-yl)methyl octadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.