3-phenyl-1H-pyrazole-4-carboxylic acid
TL;DR: 3-phenyl-1H-pyrazole-4-carboxylic acid (CAS 136523-92-7) is a chemical compound with molecular formula C10H8N2O2 and molecular weight 188.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-1H-pyrazole-4-carboxylic acid
Also Known As: 3-phenyl-1H-pyrazole-4-carboxylic acid, 5-Phenyl-1H-pyrazole-4-carboxylic acid, ChemDiv2_003454, 3-phenylpyrazole-4-carboxylic acid, 2-chloro-3-methoxy-4-pyridinamine
| Molecular Formula | C10H8N2O2 |
|---|---|
| Molecular Weight | 188.06 g/mol |
| LogP | 1.7749 |
| Topological Polar Surface Area | 65.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.05858 |
| Heavy Atoms | 14 |
| Complexity | 448.15536 |
Chemical Identifiers
| CAS Number | 136523-92-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C=NN2)C(=O)O |
Product Overview
3-phenyl-1H-pyrazole-4-carboxylic acid (CAS 136523-92-7), with molecular formula C10H8N2O2 and molecular weight 188.06 g/mol. IUPAC: 5-phenyl-1H-pyrazole-4-carboxylic acid.
Chemical Property Profile of 3-phenyl-1H-pyrazole-4-carboxylic acid
Property Insights of 3-phenyl-1H-pyrazole-4-carboxylic acid
The XLogP value of 1.7749 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-phenyl-1H-pyrazole-4-carboxylic acid. The TPSA of 65.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-phenyl-1H-pyrazole-4-carboxylic acid. Following Lipinski's Rule of Five, 3-phenyl-1H-pyrazole-4-carboxylic acid has 2 hydrogen bond donor(s) and 2 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 3-phenyl-1H-pyrazole-4-carboxylic acid?
The CAS number of 3-phenyl-1H-pyrazole-4-carboxylic acid is 136523-92-7.
What is the molecular formula of 3-phenyl-1H-pyrazole-4-carboxylic acid?
The molecular formula of 3-phenyl-1H-pyrazole-4-carboxylic acid is C10H8N2O2.
What is the molecular weight of 3-phenyl-1H-pyrazole-4-carboxylic acid?
The molecular weight of 3-phenyl-1H-pyrazole-4-carboxylic acid is 188.06 g/mol.
Where can I buy 3-phenyl-1H-pyrazole-4-carboxylic acid?
You can request a quote for 3-phenyl-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 3-phenyl-1H-pyrazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-phenyl-1H-pyrazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.