5-Acetoxy-3-phenylpyrazole
TL;DR: 5-Acetoxy-3-phenylpyrazole (CAS 32258-59-6) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-phenyl-1H-pyrazol-3-yl) acetate
Also Known As: 5-Acetoxy-3-phenylpyrazole, 5-Phenyl-1H-pyrazol-3-yl acetate, (5-phenyl-1H-pyrazol-3-yl) acetate, 5-Phenyl-1H-pyrazol-3-yl acetate #, Pyrazol-3-ol, 5-phenyl-, acetate (ester)
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 32258-59-6 |
|---|---|
| SMILES | CC(=O)OC1=NNC(=C1)C2=CC=CC=C2 |
| InChIKey | IFGQMYFESHZIRN-UHFFFAOYSA-N |
Product Overview
5-Acetoxy-3-phenylpyrazole (CAS 32258-59-6), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: (5-phenyl-1H-pyrazol-3-yl) acetate.
Chemical Property Profile of 5-Acetoxy-3-phenylpyrazole
Property Insights of 5-Acetoxy-3-phenylpyrazole
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetoxy-3-phenylpyrazole. With a topological polar surface area (TPSA) of 55.0 Ų, 5-Acetoxy-3-phenylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetoxy-3-phenylpyrazole has 1 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 5-Acetoxy-3-phenylpyrazole?
The CAS number of 5-Acetoxy-3-phenylpyrazole is 32258-59-6.
What is the molecular formula of 5-Acetoxy-3-phenylpyrazole?
The molecular formula of 5-Acetoxy-3-phenylpyrazole is C11H10N2O2.
What is the molecular weight of 5-Acetoxy-3-phenylpyrazole?
The molecular weight of 5-Acetoxy-3-phenylpyrazole is 202.07 g/mol.
Where can I buy 5-Acetoxy-3-phenylpyrazole?
You can request a quote for 5-Acetoxy-3-phenylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetoxy-3-phenylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetoxy-3-phenylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.