3-Nonenyl acetate
TL;DR: 3-Nonenyl acetate (CAS 13049-88-2) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
non-3-enyl acetate
Also Known As: 3-nonenyl acetate, Non-3-enyl acetate, non-3-en-1-yl acetate, 3-Nonen-1-ol, 1-acetate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H20O2 |
| Molecular Weight | 184.14633 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 184.14633 Da |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
| SMILES | CCCCCC=CCCOC(=O)C |
| InChIKey | LRQNQAVSERJKNU-UHFFFAOYSA-N |
Chemical Property Profile of 3-Nonenyl acetate
Property Insights of 3-Nonenyl acetate
The XLogP value of 3.5 indicates that 3-Nonenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Nonenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Nonenyl acetate 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
What is the CAS number of 3-Nonenyl acetate?
The CAS number of 3-Nonenyl acetate is 13049-88-2.
What is the molecular formula of 3-Nonenyl acetate?
The molecular formula of 3-Nonenyl acetate is C11H20O2.
What is the molecular weight of 3-Nonenyl acetate?
The molecular weight of 3-Nonenyl acetate is 184.14633 g/mol.
Where can I buy 3-Nonenyl acetate?
You can request a quote for 3-Nonenyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Nonenyl acetate?
Yes, CoreyChem provides custom synthesis services for 3-Nonenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.