(5-methyl-1H-pyrazol-1-yl)acetic acid

Base Information

• Chemical Name: (5-methyl-1H-pyrazol-1-yl)acetic acid
• CAS No.: 180741-44-0
• Molecular Formula: C₆H₈N₂O₂
• Molecular Weight: 140.142
• Hs Code.: 2933199090
• European Community (EC) Number: 675-272-2
• DSSTox Substance ID: DTXSID50426993
• Wikidata: Q82239770
• Mol file: 180741-44-0.mol

Synonyms:180741-44-0;(5-methyl-1H-pyrazol-1-yl)acetic acid;(5-Methyl-pyrazol-1-yl)-acetic acid;2-(5-Methyl-1H-Pyrazol-1-Yl)Acetic Acid;2-(5-methylpyrazol-1-yl)acetic Acid;MFCD03419599;(5-methylpyrazol-1-yl)acetic acid;SCHEMBL2175235;DTXSID50426993;ZRXVSPAUYVSVNR-UHFFFAOYSA-N;BBL016057;STK313225;AKOS000308213;AB14505;VS-05115;2-(5-Methyl-1H-pyrazol-1-yl)aceticacid;(5-METHYL-PYRAZOL-1-YL)-ACETICACID;CS-0138512;FT-0679035;EN300-83558;E81730;A881089;F2169-1102

Chemical Property of (5-methyl-1H-pyrazol-1-yl)acetic acid

Chemical Property:

• Vapor Pressure: 0.000437mmHg at 25°C
• Refractive Index: 1.573
• Boiling Point: 302.5°C at 760 mmHg
• Flash Point: 136.7°C
• PSA: 55.12000
• Density: 1.27g/cm³
• LogP: 0.27610
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 140.058577502
• Heavy Atom Count: 10
• Complexity: 138

Purity/Quality:

97% ^*data from raw suppliers

(5-Methyl-1H-pyrazol-1-yl)aceticAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=NN1CC(=O)O