Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester
TL;DR: Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester (CAS 56630-70-7) is a chemical compound with molecular formula C22H34O4 and molecular weight 362.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-phenyl-1,3-dioxan-5-yl) dodecanoate
Also Known As: 2-Phenyl-1,3-dioxan-5-yl laurate, 2-phenyl-1,3-dioxan-5-yl dodecanoate, 2-Phenyl-1,3-dioxan-5-yl laurate #, Dodecanoicacid2-phenyl-1,3-dioxan-5-ylester, (2-phenyl-1,3-dioxan-5-yl) dodecanoate
| Molecular Formula | C22H34O4 |
|---|---|
| Molecular Weight | 362.25 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 362.2457 |
| Heavy Atoms | 26 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 56630-70-7 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)OC1COC(OC1)C2=CC=CC=C2 |
| InChIKey | JIKLWCPECKYIJP-UHFFFAOYSA-N |
Product Overview
Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester (CAS 56630-70-7), with molecular formula C22H34O4 and molecular weight 362.25 g/mol. IUPAC: (2-phenyl-1,3-dioxan-5-yl) dodecanoate.
Chemical Property Profile of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester
Property Insights of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester
The XLogP value of 6.4 indicates that Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester 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 Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester?
The CAS number of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester is 56630-70-7.
What is the molecular formula of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester?
The molecular formula of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester is C22H34O4.
What is the molecular weight of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester?
The molecular weight of Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester is 362.25 g/mol.
Where can I buy Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester?
You can request a quote for Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Dodecanoic acid, 2-phenyl-1,3-dioxan-5-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.