4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid
TL;DR: 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid (CAS 13656-36-5) is a chemical compound with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
Also Known As: 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid, 4,5,6,7-Tetrahydro-2H-indazole-3-carboxylic acid, Indazole-3-carboxylic acid, indazole-3-carboxylicacid, ChemDiv2_003320
| Molecular Formula | C8H10N2O2 |
|---|---|
| Molecular Weight | 166.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.07423 |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 13656-36-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=NN2)C(=O)O |
| InChIKey | LWXNHFZBFJMHGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid (CAS 13656-36-5), with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol. IUPAC: 4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid.
Chemical Property Profile of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid
Property Insights of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid. Following Lipinski's Rule of Five, 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid has 2 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 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid?
The CAS number of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid is 13656-36-5.
What is the molecular formula of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid?
The molecular formula of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid is C8H10N2O2.
What is the molecular weight of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid?
The molecular weight of 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid is 166.07 g/mol.
Where can I buy 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid?
You can request a quote for 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.