3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylic acid

Base Information

• Chemical Name: 3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylic acid
• CAS No.: 859851-00-6
• Molecular Formula: C9H8 N2 O3
• Molecular Weight: 192.17
• Hs Code.: 2933199090
• DSSTox Substance ID: DTXSID10428776
• Wikidata: Q82241599
• Mol file: 859851-00-6.mol

Synonyms:859851-00-6;3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylic acid;3-(Furan-2-yl)-1-methyl-1H-pyrazole-5-carboxylic acid;5-(furan-2-yl)-2-methylpyrazole-3-carboxylic acid;1H-Pyrazole-5-carboxylicacid, 3-(2-furanyl)-1-methyl-;3-(Fur-2-yl)-1-methyl-1H-pyrazole-5-carboxylic acid;SCHEMBL3434179;DTXSID10428776;MFCD08271950;AKOS006345242;MS-22388;FT-0718254;EN300-238042;F1967-0159;3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylic acid, AldrichCPR;RKV

Chemical Property of 3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylic acid

Chemical Property:

• Vapor Pressure: 5.09E-07mmHg at 25°C
• Melting Point: >130
• Boiling Point: 397.1°C at 760 mmHg
• Flash Point: 194°C
• PSA: 68.26000
• Density: 1.41g/cm³
• LogP: 1.37830
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 192.05349212
• Heavy Atom Count: 14
• Complexity: 234

Purity/Quality:

98%Min ^*data from raw suppliers

3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=CC(=N1)C2=CC=CO2)C(=O)O