(5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid
TL;DR: (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid (CAS 75239-13-3) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-1-phenylpyrazol-4-yl)acetic acid
Also Known As: 5-Methyl-1-phenyl-1H-pyrazole-4-acetic acid, 2-(5-methyl-1-phenylpyrazol-4-yl)acetic acid, 2-(5-methyl-1-phenyl-pyrazol-4-yl)acetic Acid, (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid, 2-(5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | 1.80782 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 502.99225 |
Chemical Identifiers
| CAS Number | 75239-13-3 |
|---|---|
| SMILES | CC1=C(C=NN1C2=CC=CC=C2)CC(=O)O |
Product Overview
(5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid (CAS 75239-13-3), with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol. IUPAC: 2-(5-methyl-1-phenylpyrazol-4-yl)acetic acid.
Chemical Property Profile of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid
Property Insights of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid
The XLogP value of 1.80782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid. With a topological polar surface area (TPSA) of 55.12 Ų, (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid has 1 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 (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid?
The CAS number of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid is 75239-13-3.
What is the molecular formula of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid?
The molecular formula of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid is C12H12N2O2.
What is the molecular weight of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid?
The molecular weight of (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid is 216.09 g/mol.
Where can I buy (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid?
You can request a quote for (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (5-methyl-1-phenyl-1H-pyrazol-4-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.