Allyl cyclohexyloxyacetate
TL;DR: Allyl cyclohexyloxyacetate (CAS 68901-15-5) is a chemical compound with molecular formula C11H18O3 and molecular weight 198.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 2-cyclohexyloxyacetate
Also Known As: Allyl cyclohexyloxyacetate, Galbanum oxyacetate, datilat, Galbador CG, ISOANANAT
| Molecular Formula | C11H18O3 |
|---|---|
| Molecular Weight | 198.13 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 198.1256 |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 68901-15-5 |
|---|---|
| SMILES | C=CCOC(=O)COC1CCCCC1 |
| InChIKey | MBUYSYKXSMTIPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allyl cyclohexyloxyacetate (CAS 68901-15-5), with molecular formula C11H18O3 and molecular weight 198.13 g/mol. IUPAC: prop-2-enyl 2-cyclohexyloxyacetate.
Chemical Property Profile of Allyl cyclohexyloxyacetate
Property Insights of Allyl cyclohexyloxyacetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allyl cyclohexyloxyacetate. With a topological polar surface area (TPSA) of 35.5 Ų, Allyl cyclohexyloxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl cyclohexyloxyacetate has 0 hydrogen bond donor(s) and 3 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 Allyl cyclohexyloxyacetate?
The CAS number of Allyl cyclohexyloxyacetate is 68901-15-5.
What is the molecular formula of Allyl cyclohexyloxyacetate?
The molecular formula of Allyl cyclohexyloxyacetate is C11H18O3.
What is the molecular weight of Allyl cyclohexyloxyacetate?
The molecular weight of Allyl cyclohexyloxyacetate is 198.13 g/mol.
Where can I buy Allyl cyclohexyloxyacetate?
You can request a quote for Allyl cyclohexyloxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl cyclohexyloxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Allyl cyclohexyloxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.