2-Oxo-1-phenylpropyl acetate
TL;DR: 2-Oxo-1-phenylpropyl acetate (CAS 19359-68-3) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-1-phenylpropyl) acetate
Also Known As: 2-oxo-1-phenylpropyl acetate, NCIOpen2_001670, (2-oxo-1-phenylpropyl) acetate, 1-acetoxy-1-phenyl-2-propanone, alpha-Acetylbenzyl alcohol acetate
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 19359-68-3 |
|---|---|
| SMILES | CC(=O)C(C1=CC=CC=C1)OC(=O)C |
| InChIKey | VYHMUKHYGLLMEN-UHFFFAOYSA-N |
Product Overview
2-Oxo-1-phenylpropyl acetate (CAS 19359-68-3), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: (2-oxo-1-phenylpropyl) acetate.
Chemical Property Profile of 2-Oxo-1-phenylpropyl acetate
Property Insights of 2-Oxo-1-phenylpropyl acetate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-1-phenylpropyl acetate. With a topological polar surface area (TPSA) of 43.4 Ų, 2-Oxo-1-phenylpropyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-1-phenylpropyl acetate 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 2-Oxo-1-phenylpropyl acetate?
The CAS number of 2-Oxo-1-phenylpropyl acetate is 19359-68-3.
What is the molecular formula of 2-Oxo-1-phenylpropyl acetate?
The molecular formula of 2-Oxo-1-phenylpropyl acetate is C11H12O3.
What is the molecular weight of 2-Oxo-1-phenylpropyl acetate?
The molecular weight of 2-Oxo-1-phenylpropyl acetate is 192.08 g/mol.
Where can I buy 2-Oxo-1-phenylpropyl acetate?
You can request a quote for 2-Oxo-1-phenylpropyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-1-phenylpropyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-1-phenylpropyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.