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1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid structure
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1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid

TL;DR: 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid (CAS 1001519-22-7) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[(2-methylphenoxy)methyl]pyrazole-3-carboxylic acid

Also Known As: 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid, 1-((o-Tolyloxy)methyl)-1H-pyrazole-3-carboxylic acid, 1-[(2-methylphenoxy)methyl]pyrazole-3-carboxylic Acid, 1-(2-methylphenoxymethyl)-1H-pyrazole-3-carboxylic acid, 1- o -Tolyloxymethyl-1 H -pyrazole-3-carboxylic acid

CAS Number
1001519-22-7
Molecular Formula
C12H12N2O3
Molecular Weight
232.0848 g/mol
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Technical Specifications

Molecular FormulaC12H12N2O3
Molecular Weight232.0848 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)64.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass232.0848 Da
Heavy Atoms17
Complexity272.0
SMILESCC1=CC=CC=C1OCN2C=CC(=N2)C(=O)O
InChIKeyRZUXYMCOMNLXBT-UHFFFAOYSA-N

Chemical Property Profile of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid

XLogP
2.2
TPSA (Topological Polar Surface Area)
64.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
17
Complexity
272.0
Exact Mass
232.0848
Monoisotopic Mass
232.0848
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid?

The CAS number of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid is 1001519-22-7.

What is the molecular formula of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid?

The molecular formula of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid is C12H12N2O3.

What is the molecular weight of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid?

The molecular weight of 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid is 232.0848 g/mol.

Where can I buy 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid?

You can request a quote for 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid?

Yes, CoreyChem provides custom synthesis services for 1-[(2-methylphenoxy)methyl]-1H-pyrazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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