Butyl 10-undecenoate
TL;DR: Butyl 10-undecenoate (CAS 109-42-2) is a chemical compound with molecular formula C15H28O2 and molecular weight 240.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl undec-10-enoate
Also Known As: Butyl undec-10-enoate, Butyl 10-undecenoate, Butyl undecylenate, Butyl 10-undecylenate, butyl undecenoate
| Molecular Formula | C15H28O2 |
|---|---|
| Molecular Weight | 240.21 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 240.20892 |
| Heavy Atoms | 17 |
| Complexity | 187.0 |
| Boiling Point | 249.00 to 254.00 °C. @ 756.00 mm Hg |
| Density | 0.872-0.878 (20°) |
| Refractive Index | 1.439-1.445 |
Chemical Identifiers
| CAS Number | 109-42-2 |
|---|---|
| SMILES | CCCCOC(=O)CCCCCCCCC=C |
| InChIKey | GRAORJFMGCQWRN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl 10-undecenoate (CAS 109-42-2), with molecular formula C15H28O2 and molecular weight 240.21 g/mol. IUPAC: butyl undec-10-enoate.
Chemical Property Profile of Butyl 10-undecenoate
Property Insights of Butyl 10-undecenoate
The XLogP value of 5.5 indicates that Butyl 10-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, Butyl 10-undecenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 10-undecenoate 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 Butyl 10-undecenoate?
The CAS number of Butyl 10-undecenoate is 109-42-2.
What is the molecular formula of Butyl 10-undecenoate?
The molecular formula of Butyl 10-undecenoate is C15H28O2.
What is the molecular weight of Butyl 10-undecenoate?
The molecular weight of Butyl 10-undecenoate is 240.21 g/mol.
Where can I buy Butyl 10-undecenoate?
You can request a quote for Butyl 10-undecenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 10-undecenoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 10-undecenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.