2-(3-methyl-1H-pyrazol-1-yl)benzoic acid
TL;DR: 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid (CAS 1020703-44-9) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-methylpyrazol-1-yl)benzoic acid
Also Known As: 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid, 2-(3-methylpyrazol-1-yl)benzoic Acid, 2-(3-methyl-1H-pyrazol-1-yl)benzoicacid, Benzoic acid, 2-(3-methyl-1H-pyrazol-1-yl)-, 867-733-3
Technical Specifications
| Molecular Formula | C11H10N2O2 |
| Molecular Weight | 202.07423 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 Da |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
| SMILES | CC1=NN(C=C1)C2=CC=CC=C2C(=O)O |
| InChIKey | NWGNIDQETDJEDN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid
Property Insights of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid. With a topological polar surface area (TPSA) of 55.1 Ų, 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid?
The CAS number of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid is 1020703-44-9.
What is the molecular formula of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid?
The molecular formula of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid is C11H10N2O2.
What is the molecular weight of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid?
The molecular weight of 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid is 202.07423 g/mol.
Where can I buy 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid?
You can request a quote for 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(3-methyl-1H-pyrazol-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.