| Identification | Back Directory | [Name]
4-(3,5-DIMETHYL-1H-PYRAZOL-4-YL)-BENZOIC ACID | [CAS]
185252-69-1 | [Synonyms]
4-(3,5-Dimethyl-4-pyrazolyl)benzoic Acid
4-(3,5-DIMETHYL-1H-PYRAZOL-4-YL)-BENZOIC ACID
Benzoic acid, 4-(3,5-dimethyl-1H-pyrazol-4-yl)- | [Molecular Formula]
C12H12N2O2 | [MDL Number]
MFCD03425153 | [MOL File]
185252-69-1.mol | [Molecular Weight]
216.24 |
| Chemical Properties | Back Directory | [Melting point ]
126 °C | [Boiling point ]
420.8±45.0 °C(Predicted) | [density ]
1.262±0.06 g/cm3(Predicted) | [pka]
4.11±0.10(Predicted) | [InChI]
InChI=1S/C12H12N2O2/c1-7-11(8(2)14-13-7)9-3-5-10(6-4-9)12(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16) | [InChIKey]
JYRIFOAFECWGHB-UHFFFAOYSA-N | [SMILES]
C(O)(=O)C1=CC=C(C2=C(C)NN=C2C)C=C1 |
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