2-(3-(4-Methoxyphenyl)-1H-pyrazol-1-yl)acetic acid

Base Information

• Chemical Name: 2-(3-(4-Methoxyphenyl)-1H-pyrazol-1-yl)acetic acid
• CAS No.: 959584-25-9
• Molecular Formula: C12H12N2O3
• Molecular Weight: 232.23528
• Hs Code.: 2933199090
• DSSTox Substance ID: DTXSID60371586
• Wikidata: Q82158955
• Mol file: 959584-25-9.mol

Synonyms:959584-25-9;2-(3-(4-Methoxyphenyl)-1H-pyrazol-1-yl)acetic acid;2-[3-(4-methoxyphenyl)pyrazol-1-yl]acetic Acid;[3-(4-methoxyphenyl)-1H-pyrazol-1-yl]acetic acid;2-[3-(4-Methoxyphenyl)-1H-Pyrazol-1-Yl]Acetic Acid;[3-(4-methoxyphenyl)pyrazol-1-yl]acetic acid;2-(3-(4-Methoxyphenyl)-1H-pyrazol-1-yl)aceticacid;3-(4-METHOXYPHENYL)-1H-PYRAZOL-1-YLACETIC ACID;DTXSID60371586;HRGBMNMEZRJNAK-UHFFFAOYSA-N;MFCD00665860;STK503389;AKOS005171581;PS-4867;BB 0237705;CS-0312669;[3-(4-Methoxy-phenyl)-pyrazol-1-yl]-acetic acid;3-(4-Methoxyphenyl)-(1H-pyrazol-1-yl)acetic acid;3-(4-methoxyphenyl)-1H-pyrazol-1-ylacetic acid, AldrichCPR

Chemical Property of 2-(3-(4-Methoxyphenyl)-1H-pyrazol-1-yl)acetic acid

Chemical Property:

• Boiling Point: 444.2±35.0 °C(Predicted)
• PKA: 3.61±0.10(Predicted)
• PSA: 64.35000
• Density: 1.25±0.1 g/cm3(Predicted)
• LogP: 1.64330
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 232.08479225
• Heavy Atom Count: 17
• Complexity: 265

Purity/Quality:

98%min ^*data from raw suppliers

3-(4-Methoxyphenyl)-(1H-pyrazol-1-yl)acetic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=NN(C=C2)CC(=O)O