Nonyl butyrate
TL;DR: Nonyl butyrate (CAS 2639-64-7) is a chemical compound with molecular formula C13H26O2 and molecular weight 214.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonyl butanoate
Also Known As: Nonyl butyrate, nonyl butanoate, Nonyl butyrate #, Butanoic acid, nonyl ester, Butanoic acid nonyl ester
| Molecular Formula | C13H26O2 |
|---|---|
| Molecular Weight | 214.19 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 214.19328 |
| Heavy Atoms | 15 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 2639-64-7 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)CCC |
| InChIKey | RVNCBAPCNVAWOY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nonyl butyrate (CAS 2639-64-7), with molecular formula C13H26O2 and molecular weight 214.19 g/mol. IUPAC: nonyl butanoate.
Chemical Property Profile of Nonyl butyrate
Property Insights of Nonyl butyrate
The XLogP value of 4.8 indicates that Nonyl butyrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Nonyl butyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonyl butyrate 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 Nonyl butyrate?
The CAS number of Nonyl butyrate is 2639-64-7.
What is the molecular formula of Nonyl butyrate?
The molecular formula of Nonyl butyrate is C13H26O2.
What is the molecular weight of Nonyl butyrate?
The molecular weight of Nonyl butyrate is 214.19 g/mol.
Where can I buy Nonyl butyrate?
You can request a quote for Nonyl butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonyl butyrate?
Yes, KEHONG BIO provides custom synthesis services for Nonyl butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.