Isopropyl dodecanoate
TL;DR: Isopropyl dodecanoate (CAS 10233-13-3) is a chemical compound with molecular formula C15H30O2 and molecular weight 242.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl dodecanoate
Also Known As: Isopropyl dodecanoate, ISOPROPYL LAURATE, propan-2-yl dodecanoate, Isopropyl_laurate, Dodecanoic acid, 1-methylethyl ester
| Molecular Formula | C15H30O2 |
|---|---|
| Molecular Weight | 242.22 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 242.22458 |
| Heavy Atoms | 17 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 10233-13-3 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)OC(C)C |
| InChIKey | UJPPXNXOEVDSRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropyl dodecanoate (CAS 10233-13-3), with molecular formula C15H30O2 and molecular weight 242.22 g/mol. IUPAC: propan-2-yl dodecanoate.
Chemical Property Profile of Isopropyl dodecanoate
Property Insights of Isopropyl dodecanoate
The XLogP value of 6.1 indicates that Isopropyl dodecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropyl dodecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl dodecanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isopropyl dodecanoate?
The CAS number of Isopropyl dodecanoate is 10233-13-3.
What is the molecular formula of Isopropyl dodecanoate?
The molecular formula of Isopropyl dodecanoate is C15H30O2.
What is the molecular weight of Isopropyl dodecanoate?
The molecular weight of Isopropyl dodecanoate is 242.22 g/mol.
Where can I buy Isopropyl dodecanoate?
You can request a quote for Isopropyl dodecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl dodecanoate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl dodecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.