4-[(3-amino-1H-pyrazol-1-yl)methyl]benzoic acid

Base Information

• Chemical Name: 4-[(3-amino-1H-pyrazol-1-yl)methyl]benzoic acid
• CAS No.: 1006348-84-0
• Molecular Formula: C11H11N3O2
• Molecular Weight: 217.22
• DSSTox Substance ID: DTXSID001242693
• Mol file: 1006348-84-0.mol

Synonyms:1006348-84-0;4-[(3-amino-1H-pyrazol-1-yl)methyl]benzoic acid;4-[(3-aminopyrazol-1-yl)methyl]benzoic acid;4-((3-Amino-1H-pyrazol-1-yl)methyl)benzoic acid;DTXSID001242693;MFCD04969600;STK349566;AKOS000310110;CS-0264427;EN300-92774;4-((3-Amino-1H-pyrazol-1-yl)methyl)benzoicacid

Chemical Property of 4-[(3-amino-1H-pyrazol-1-yl)methyl]benzoic acid

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 217.085126602
• Heavy Atom Count: 16
• Complexity: 252

Purity/Quality:

4-[(3-Amino-1H-pyrazol-1-yl)methyl]benzoicAcid ^*data from reagent suppliers

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1CN2C=CC(=N2)N)C(=O)O

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