methyl 5-bromo-4-nitro-1H-indazole-3-carboxylate

Base Information

• Chemical Name: methyl 5-bromo-4-nitro-1H-indazole-3-carboxylate
• CAS No.: 1403767-11-2
• Molecular Formula: C9H6BrN3O4
• Molecular Weight: 300.07
• DSSTox Substance ID: DTXSID601181831
• Mol file: 1403767-11-2.mol

Synonyms:methyl 5-bromo-4-nitro-1H-indazole-3-carboxylate;1403767-11-2;1H-Indazole-3-carboxylic acid, 5-bromo-4-nitro-, methyl ester;DTXSID601181831;AMY35354;MFCD23106303;AKOS025289864;PB36013;SB21745;AS-34809;CS-0048995;methyl5-bromo-4-nitro-1H-indazole-3-carboxylate

Chemical Property of methyl 5-bromo-4-nitro-1H-indazole-3-carboxylate

Chemical Property:

• PKA: 7.75±0.40(Predicted)
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 298.95417
• Heavy Atom Count: 17
• Complexity: 335

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl5-bromo-4-nitro-1H-indazole-3-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=NNC2=C1C(=C(C=C2)Br)[N+](=O)[O-]