ChemicalBook--->CAS DataBase List--->4522-35-4

4522-35-4

4522-35-4 Structure

4522-35-4 Structure
IdentificationBack Directory
[Name]

3-Iodo-1H-pyrazole
[CAS]

4522-35-4
[Synonyms]

3-Iodopyrazole
3-Iodo-1H-pyrazole
1H-Pyrazole, 3-iodo-
3-Iodo-1H-pyrazole≥ 98% (GC)
3-Iodo-1H-Pyrazole(WX638030)
3-Iodo-1H-pyrazole ISO 9001:2015 REACH
[Molecular Formula]

C3H3IN2
[MDL Number]

MFCD12022324
[MOL File]

4522-35-4.mol
[Molecular Weight]

193.971
Chemical PropertiesBack Directory
[Melting point ]

74-75°
[Boiling point ]

291.9±13.0 °C(Predicted)
[density ]

2.335±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

11.20±0.10(Predicted)
[color ]

White to Yellow to Green
[Water Solubility ]

Insoluble in water.
[Sensitive ]

Light Sensitive
[InChI]

InChI=1S/C3H3IN2/c4-3-1-2-5-6-3/h1-2H,(H,5,6)
[InChIKey]

RUKDVLFJSMVBLV-UHFFFAOYSA-N
[SMILES]

N1C=CC(I)=N1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[HS Code ]

2933199090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

White to off-white crystalline solid
[Uses]

3-Iodo-1H-pyrazole is used as pharmaceutical intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Iodo-1H-pyrazole(4522-35-4)1HNMR
3-Iodo-1H-pyrazole(4522-35-4)FT-IR
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