(4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate
TL;DR: (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate (CAS 53890-21-4) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1-acetyloxyprop-2-enyl)phenyl] acetate
Also Known As: Galangal acetate, 1'-Acetoxychavicol acetate, Galangal acetate, (RS)-, Galangal acetate, (+/-)-, 1'-Acetoxychavicol acetate, (+/-)-
| Molecular Formula | C13H14O4 |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 234.0892 |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 53890-21-4 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C(C=C)OC(=O)C |
| InChIKey | JAMQIUWGGBSIKZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate (CAS 53890-21-4), with molecular formula C13H14O4 and molecular weight 234.09 g/mol. IUPAC: [4-(1-acetyloxyprop-2-enyl)phenyl] acetate.
Chemical Property Profile of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate
Property Insights of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate. With a topological polar surface area (TPSA) of 52.6 Ų, (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate has 0 hydrogen bond donor(s) and 4 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 (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate?
The CAS number of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate is 53890-21-4.
What is the molecular formula of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate?
The molecular formula of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate is C13H14O4.
What is the molecular weight of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate?
The molecular weight of (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate is 234.09 g/mol.
Where can I buy (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate?
You can request a quote for (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate?
Yes, KEHONG BIO provides custom synthesis services for (4-(1-Acetyloxyprop-2-Enyl)Phenyl) Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.