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54705-91-8

54705-91-8 Structure

54705-91-8 Structure
IdentificationBack Directory
[Name]

2-(1H-PYRAZOL-1-YL)ANILINE
[CAS]

54705-91-8
[Synonyms]

AKOS B033138
2-(1-Pyrazolyl)aniline
2-(Pyrazol-1-yl)aniline
1-(2-Aminophenyl)pyrazole
2-(1H-PYRAZOL-1-YL)ANILINE
2-Pyrazol-1-yl-phenylamine
1-(2-Aminophenyl)-1H-pyrazole
Benzenamine, 2-(1H-pyrazol-1-yl)-
1-(2-Aminophenyl)-1H-pyrazole 97%
2-(1H-pyrazol-1-yl)aniline(SALTDATA: FREE)
[Molecular Formula]

C9H9N3
[MDL Number]

MFCD03086227
[MOL File]

54705-91-8.mol
[Molecular Weight]

159.19
Chemical PropertiesBack Directory
[Melting point ]

44-46°C
[Boiling point ]

305.4±15.0 °C(Predicted)
[density ]

1.20±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[form ]

solid
[pka]

1.97±0.10(Predicted)
[Appearance]

Light yellow to light brown Solid
[InChI]

1S/C9H9N3/c10-8-4-1-2-5-9(8)12-7-3-6-11-12/h1-7H,10H2
[InChIKey]

UIYKQBXRFZCXFX-UHFFFAOYSA-N
[SMILES]

Nc1ccccc1-n2cccn2
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37/39
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

2933199090
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

2-(1H-Pyrazol-1-yl)aniline is used in the preparation of benzenesulfonamide derivatives and analogs as ATP citrate lyase inhibitors.
[Definition]

ChEBI: 2-(1H-pyrazol-1-yl)aniline is a ring assembly and a member of pyrazoles.
Spectrum DetailBack Directory
[Spectrum Detail]

2-(1H-PYRAZOL-1-YL)ANILINE(54705-91-8)1HNMR
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