Benzyl undecanoate
TL;DR: Benzyl undecanoate (CAS 64273-11-6) is a chemical compound with molecular formula C18H28O2 and molecular weight 276.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl undecanoate
Also Known As: Benzyl undecanoate, Benzylundecanoat, Undecanoicacidbenzylester, Benzyl undecanoate #, Undecanoic acid benzyl ester
| Molecular Formula | C18H28O2 |
|---|---|
| Molecular Weight | 276.21 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 276.20892 |
| Heavy Atoms | 20 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 64273-11-6 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)OCC1=CC=CC=C1 |
| InChIKey | BBDULIAMCCXFCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl undecanoate (CAS 64273-11-6), with molecular formula C18H28O2 and molecular weight 276.21 g/mol. IUPAC: benzyl undecanoate.
Chemical Property Profile of Benzyl undecanoate
Property Insights of Benzyl undecanoate
The XLogP value of 6.2 indicates that Benzyl 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, Benzyl undecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 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 Benzyl undecanoate?
The CAS number of Benzyl undecanoate is 64273-11-6.
What is the molecular formula of Benzyl undecanoate?
The molecular formula of Benzyl undecanoate is C18H28O2.
What is the molecular weight of Benzyl undecanoate?
The molecular weight of Benzyl undecanoate is 276.21 g/mol.
Where can I buy Benzyl undecanoate?
You can request a quote for Benzyl undecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl undecanoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl undecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.