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879996-71-1

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879996-71-1 Structure

879996-71-1 Structure
IdentificationBack Directory
[Name]

3-(3-methoxyphenyl)-1H-pyrazole-4-carboxylic acid
[CAS]

879996-71-1
[Synonyms]

UKRORGSYN-BB BBV-229827
5-(3-Methoxy-phenyl)-1H-pyrazol-4-carboxylic acid
3-(3-methoxyphenyl)-1H-pyrazole-4-carboxylic acid
1H-Pyrazole-4-carboxylic acid, 3-(3-methoxyphenyl)-
3-(3-methoxyphenyl)-1H-pyrazole-4-carboxylic acid(SALTDATA: FREE)
[Molecular Formula]

C11H10N2O3
[MDL Number]

MFCD09055304
[MOL File]

879996-71-1.mol
[Molecular Weight]

218.21
Chemical PropertiesBack Directory
[Melting point ]

>270 °C
[Boiling point ]

448.8±30.0 °C(Predicted)
[density ]

1.340±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

3.53±0.36(Predicted)
[InChI]

1S/C11H10N2O3/c1-16-8-4-2-3-7(5-8)10-9(11(14)15)6-12-13-10/h2-6H,1H3,(H,12,13)(H,14,15)
[InChIKey]

VVUVPSNFYCNORL-UHFFFAOYSA-N
[SMILES]

COC1=CC(C2=C(C(O)=O)C=NN2)=CC=C1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
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