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

Base Information

• Chemical Name: (4-bromo-5-methyl-1H-pyrazol-1-yl)acetic acid
• CAS No.: 512809-63-1
• Molecular Formula: C6H7BrN2O2
• Molecular Weight: 219.04
• Hs Code.: 2933199090
• European Community (EC) Number: 817-521-1
• DSSTox Substance ID: DTXSID30392187
• Wikidata: Q82190191
• Mol file: 512809-63-1.mol

Synonyms:(4-bromo-5-methyl-1H-pyrazol-1-yl)acetic acid;512809-63-1;2-(4-bromo-5-methyl-1H-pyrazol-1-yl)acetic acid;2-(4-bromo-5-methylpyrazol-1-yl)acetic acid;MFCD03074362;2-(4-bromo-5-methyl-pyrazol-1-yl)acetic Acid;SCHEMBL13401737;DTXSID30392187;STK349008;AKOS000307901;LS-07054;CS-0217735;EN300-83550;2-(4-bromo-5-methyl-1H-pyrazol-1-yl)aceticacid;AK-968/41170109;F2169-1101;(4-bromo-5-methyl-pyrazol-1-yl)-acetic acid, AldrichCPR

Chemical Property of (4-bromo-5-methyl-1H-pyrazol-1-yl)acetic acid

Chemical Property:

• Vapor Pressure: 7.51E-06mmHg at 25°C
• Boiling Point: 361.3°C at 760 mmHg
• Flash Point: 172.3°C
• PSA: 55.12000
• Density: 1.79g/cm³
• LogP: 1.03860
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 217.96909
• Heavy Atom Count: 11
• Complexity: 165

Purity/Quality:

97% ^*data from raw suppliers

(4-bromo-5-methyl-1H-pyrazol-1-yl)aceticAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=NN1CC(=O)O)Br