Methyl undecanoate
TL;DR: Methyl undecanoate (CAS 1731-86-8) is a chemical compound with molecular formula C12H24O2 and molecular weight 200.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl undecanoate
Also Known As: METHYL UNDECANOATE, Undecanoic acid, methyl ester, Methyl n-undecanoate, Undecanoic acid methyl ester, methylundecanoate
| Molecular Formula | C12H24O2 |
|---|---|
| Molecular Weight | 200.18 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 200.17763 |
| Heavy Atoms | 14 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 1731-86-8 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)OC |
| InChIKey | XPQPWPZFBULGKT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl undecanoate (CAS 1731-86-8), with molecular formula C12H24O2 and molecular weight 200.18 g/mol. IUPAC: methyl undecanoate.
Chemical Property Profile of Methyl undecanoate
Property Insights of Methyl undecanoate
The XLogP value of 5.2 indicates that Methyl undecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl undecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl undecanoate 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 Methyl undecanoate?
The CAS number of Methyl undecanoate is 1731-86-8.
What is the molecular formula of Methyl undecanoate?
The molecular formula of Methyl undecanoate is C12H24O2.
What is the molecular weight of Methyl undecanoate?
The molecular weight of Methyl undecanoate is 200.18 g/mol.
Where can I buy Methyl undecanoate?
You can request a quote for Methyl undecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl undecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl undecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.