Lavandulyl acetate
TL;DR: Lavandulyl acetate (CAS 25905-14-0) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-prop-1-en-2-ylhex-4-enyl) acetate
Also Known As: Lavandulyl acetate, (+/-)-Lavandulyl acetate, (R)-Lavandulyl acetate, lavandulol acetate, lavandulyl acatate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 25905-14-0 |
|---|---|
| SMILES | CC(=CCC(COC(=O)C)C(=C)C)C |
| InChIKey | HYNGAVZPWWXQIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Lavandulyl acetate (CAS 25905-14-0), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: (5-methyl-2-prop-1-en-2-ylhex-4-enyl) acetate.
Chemical Property Profile of Lavandulyl acetate
Property Insights of Lavandulyl acetate
The XLogP value of 3.6 indicates that Lavandulyl 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, Lavandulyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lavandulyl 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
Frequently Asked Questions
What is the CAS number of Lavandulyl acetate?
The CAS number of Lavandulyl acetate is 25905-14-0.
What is the molecular formula of Lavandulyl acetate?
The molecular formula of Lavandulyl acetate is C12H20O2.
What is the molecular weight of Lavandulyl acetate?
The molecular weight of Lavandulyl acetate is 196.15 g/mol.
Where can I buy Lavandulyl acetate?
You can request a quote for Lavandulyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lavandulyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Lavandulyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.