Benzyl caprate
TL;DR: Benzyl caprate (CAS 42175-41-7) is a chemical compound with molecular formula C17H26O2 and molecular weight 262.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl decanoate
Also Known As: Benzyl decanoate, benzyl caprate, benzyldecanoate, Phenylmethyl decanoate, Benzyl decanoate #
| Molecular Formula | C17H26O2 |
|---|---|
| Molecular Weight | 262.19 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 262.19327 |
| Heavy Atoms | 19 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 42175-41-7 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OCC1=CC=CC=C1 |
| InChIKey | ZSAYVPCIKVBDRI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl caprate (CAS 42175-41-7), with molecular formula C17H26O2 and molecular weight 262.19 g/mol. IUPAC: benzyl decanoate.
Chemical Property Profile of Benzyl caprate
Property Insights of Benzyl caprate
The XLogP value of 5.7 indicates that Benzyl caprate 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 caprate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl caprate 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 caprate?
The CAS number of Benzyl caprate is 42175-41-7.
What is the molecular formula of Benzyl caprate?
The molecular formula of Benzyl caprate is C17H26O2.
What is the molecular weight of Benzyl caprate?
The molecular weight of Benzyl caprate is 262.19 g/mol.
Where can I buy Benzyl caprate?
You can request a quote for Benzyl caprate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl caprate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl caprate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.