2-(Acetyloxy)-3-fluorophenyl acetate
TL;DR: 2-(Acetyloxy)-3-fluorophenyl acetate (CAS 55030-67-6) is a chemical compound with molecular formula C10H9FO4 and molecular weight 212.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetyloxy-3-fluorophenyl) acetate
Also Known As: 2-(Acetyloxy)-3-fluorophenyl acetate, Diacetic acid 3-fluoro-1,2-phenylene ester, (2-acetyloxy-3-fluorophenyl) acetate, 2-(acetyloxy)-6-fluorophenyl acetate, 2-acetyloxy-6-fluorophenyl acetate
| Molecular Formula | C10H9FO4 |
|---|---|
| Molecular Weight | 212.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.0485 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 55030-67-6 |
|---|---|
| SMILES | CC(=O)OC1=C(C(=CC=C1)F)OC(=O)C |
| InChIKey | SFTJLHYKOIAVMI-UHFFFAOYSA-N |
Product Overview
2-(Acetyloxy)-3-fluorophenyl acetate (CAS 55030-67-6), with molecular formula C10H9FO4 and molecular weight 212.05 g/mol. IUPAC: (2-acetyloxy-3-fluorophenyl) acetate.
Chemical Property Profile of 2-(Acetyloxy)-3-fluorophenyl acetate
Property Insights of 2-(Acetyloxy)-3-fluorophenyl acetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetyloxy)-3-fluorophenyl acetate. With a topological polar surface area (TPSA) of 52.6 Ų, 2-(Acetyloxy)-3-fluorophenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Acetyloxy)-3-fluorophenyl acetate has 0 hydrogen bond donor(s) and 5 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-(Acetyloxy)-3-fluorophenyl acetate?
The CAS number of 2-(Acetyloxy)-3-fluorophenyl acetate is 55030-67-6.
What is the molecular formula of 2-(Acetyloxy)-3-fluorophenyl acetate?
The molecular formula of 2-(Acetyloxy)-3-fluorophenyl acetate is C10H9FO4.
What is the molecular weight of 2-(Acetyloxy)-3-fluorophenyl acetate?
The molecular weight of 2-(Acetyloxy)-3-fluorophenyl acetate is 212.05 g/mol.
Where can I buy 2-(Acetyloxy)-3-fluorophenyl acetate?
You can request a quote for 2-(Acetyloxy)-3-fluorophenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Acetyloxy)-3-fluorophenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Acetyloxy)-3-fluorophenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.