Isobutyl laurate
TL;DR: Isobutyl laurate (CAS 37811-72-6) is a chemical compound with molecular formula C16H32O2 and molecular weight 256.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl dodecanoate
Also Known As: Isobutyl laurate, Lauric acid isobutyl ester, 2-Methylpropyl dodecanoate, ISOBUTYL DODECANOATE, Isobutyl=laurate
| Molecular Formula | C16H32O2 |
|---|---|
| Molecular Weight | 256.24 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 256.24023 |
| Heavy Atoms | 18 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 37811-72-6 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)OCC(C)C |
| InChIKey | SZFOMJOELAAHAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isobutyl laurate (CAS 37811-72-6), with molecular formula C16H32O2 and molecular weight 256.24 g/mol. IUPAC: 2-methylpropyl dodecanoate.
Chemical Property Profile of Isobutyl laurate
Property Insights of Isobutyl laurate
The XLogP value of 6.6 indicates that Isobutyl laurate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Isobutyl laurate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutyl laurate 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 Isobutyl laurate?
The CAS number of Isobutyl laurate is 37811-72-6.
What is the molecular formula of Isobutyl laurate?
The molecular formula of Isobutyl laurate is C16H32O2.
What is the molecular weight of Isobutyl laurate?
The molecular weight of Isobutyl laurate is 256.24 g/mol.
Where can I buy Isobutyl laurate?
You can request a quote for Isobutyl laurate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isobutyl laurate?
Yes, KEHONG BIO provides custom synthesis services for Isobutyl laurate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.