1H-Indazol-5-ol, 1-acetyl-, acetate (ester)
TL;DR: 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) (CAS 40939-85-3) is a chemical compound with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-acetylindazol-5-yl) acetate
Also Known As: 1-acetyl-1h-indazol-5-yl acetate, (1-acetylindazol-5-yl) acetate, Acetyl-1 acetoxy-5 indazole, Acetyl-1 acetoxy-5 indazole [French], 1-Acetyl-1H-indazol-5-ylacetate
| Molecular Formula | C11H10N2O3 |
|---|---|
| Molecular Weight | 218.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 61.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.06914 |
| Heavy Atoms | 16 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 40939-85-3 |
|---|---|
| SMILES | CC(=O)N1C2=C(C=C(C=C2)OC(=O)C)C=N1 |
| InChIKey | STKYXVXUUPIMSU-UHFFFAOYSA-N |
Product Overview
1H-Indazol-5-ol, 1-acetyl-, acetate (ester) (CAS 40939-85-3), with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol. IUPAC: (1-acetylindazol-5-yl) acetate.
Chemical Property Profile of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)
Property Insights of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indazol-5-ol, 1-acetyl-, acetate (ester). The TPSA of 61.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indazol-5-ol, 1-acetyl-, acetate (ester). Following Lipinski's Rule of Five, 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) 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 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)?
The CAS number of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) is 40939-85-3.
What is the molecular formula of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)?
The molecular formula of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) is C11H10N2O3.
What is the molecular weight of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)?
The molecular weight of 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) is 218.07 g/mol.
Where can I buy 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)?
You can request a quote for 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indazol-5-ol, 1-acetyl-, acetate (ester)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indazol-5-ol, 1-acetyl-, acetate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.