Phenacyl formate
TL;DR: Phenacyl formate (CAS 55153-12-3) is a chemical compound with molecular formula C9H8O3 and molecular weight 164.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl formate
Also Known As: phenacyl formate, formyloxyacetophenone, 2-Oxo-2-phenylethyl formate, Ethanone, 2-(formyloxy)-1-phenyl-, 2-(Formyloxy)-1-phenylethanone
| Molecular Formula | C9H8O3 |
|---|---|
| Molecular Weight | 164.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 164.04735 |
| Heavy Atoms | 12 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 55153-12-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC=O |
| InChIKey | RJJPGLSTUHHJOX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenacyl formate (CAS 55153-12-3), with molecular formula C9H8O3 and molecular weight 164.05 g/mol. IUPAC: phenacyl formate.
Chemical Property Profile of Phenacyl formate
Property Insights of Phenacyl formate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenacyl formate. With a topological polar surface area (TPSA) of 43.4 Ų, Phenacyl formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenacyl formate 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 Phenacyl formate?
The CAS number of Phenacyl formate is 55153-12-3.
What is the molecular formula of Phenacyl formate?
The molecular formula of Phenacyl formate is C9H8O3.
What is the molecular weight of Phenacyl formate?
The molecular weight of Phenacyl formate is 164.05 g/mol.
Where can I buy Phenacyl formate?
You can request a quote for Phenacyl formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenacyl formate?
Yes, KEHONG BIO provides custom synthesis services for Phenacyl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.