Methyl 2-undecenoate
TL;DR: Methyl 2-undecenoate (CAS 22104-71-8) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-undec-2-enoate
Also Known As: methyl 2-undecenoate, Methyl undecenoate, methyl undec-2-enoate, 1-methylundec-2-enoate, methyl (2E)-2-undecenoate
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 3.4662 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 161.70467 |
Chemical Identifiers
| CAS Number | 22104-71-8 |
|---|---|
| SMILES | CCCCCCCC/C=C/C(=O)OC |
Product Overview
Methyl 2-undecenoate (CAS 22104-71-8), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: methyl (E)-undec-2-enoate.
Chemical Property Profile of Methyl 2-undecenoate
Property Insights of Methyl 2-undecenoate
The XLogP value of 3.4662 indicates that Methyl 2-undecenoate 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 2-undecenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-undecenoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-undecenoate?
The CAS number of Methyl 2-undecenoate is 22104-71-8.
What is the molecular formula of Methyl 2-undecenoate?
The molecular formula of Methyl 2-undecenoate is C12H22O2.
What is the molecular weight of Methyl 2-undecenoate?
The molecular weight of Methyl 2-undecenoate is 198.16 g/mol.
Where can I buy Methyl 2-undecenoate?
You can request a quote for Methyl 2-undecenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-undecenoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-undecenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.