5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid
TL;DR: 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid (CAS 1011355-63-7) is a chemical compound with molecular formula C5H4N6O2 and molecular weight 180.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid
Also Known As: 3-Tetrazol-1-yl-1H-pyrazole-4-carboxylic acid, 5-(1h-tetrazol-1-yl)-1h-pyrazole-4-carboxylic acid, 5-(tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid, KSC-10-142, BAS 10146275
| Molecular Formula | C5H4N6O2 |
|---|---|
| Molecular Weight | 180.04 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.03957 |
| Heavy Atoms | 13 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 1011355-63-7 |
|---|---|
| SMILES | C1=NNC(=C1C(=O)O)N2C=NN=N2 |
| InChIKey | QRWRAPLZMIQPNY-UHFFFAOYSA-N |
Product Overview
5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid (CAS 1011355-63-7), with molecular formula C5H4N6O2 and molecular weight 180.04 g/mol. IUPAC: 5-(tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid.
Chemical Property Profile of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid
Property Insights of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid
The XLogP value of -0.6 indicates that 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid. Following Lipinski's Rule of Five, 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid has 2 hydrogen bond donor(s) and 6 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-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid?
The CAS number of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid is 1011355-63-7.
What is the molecular formula of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid?
The molecular formula of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid is C5H4N6O2.
What is the molecular weight of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid?
The molecular weight of 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid is 180.04 g/mol.
Where can I buy 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid?
You can request a quote for 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(1H-1,2,3,4-tetrazol-1-yl)-1H-pyrazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.