ChemicalBook--->CAS DataBase List--->1346604-13-4

1346604-13-4

1346604-13-4 Structure

1346604-13-4 Structure
IdentificationBack Directory
[Name]

ALLOPURINOL IMPURITY C
[CAS]

1346604-13-4
[Synonyms]

synthesis-005
Allopurinol-001
Allopurinol EP Imp C
ALLOPURINOL IMPURITY C
Allopurinol Related CoMpound C
5-(1,2,4-triazol-4-yl)-1H-pyrazole-4-carboxamide
5-(4H-1,2,4-Triazol-4-yl)-1H-pyrazole-4-carboxamide
1H-Pyrazole-4-carboxamide, 3-(4H-1,2,4-triazol-4-yl)-
Allopurinol EP impurity C/ Allopurinol Related Compound C
Allopurinol EP Impurity C(Allopurinol USP Related Compound C)
Allopurinol EP Impurity C or Allopurinol USP Related Compound C
Allopurinol Impurity 3(Allopurinol EP Impurity C)(Allopurinol USP Related Compound C )
[Molecular Formula]

C6H6N6O
[MDL Number]

MFCD21363439
[MOL File]

1346604-13-4.mol
[Molecular Weight]

178.15
Chemical PropertiesBack Directory
[Boiling point ]

579.3±60.0 °C(Predicted)
[density ]

1.85±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

Aqueous Base (Slightly, Heated), DMSO (Slightly)
[form ]

neat
[pka]

9.36±0.50(Predicted)
[Major Application]

pharmaceutical
[InChI]

InChI=1S/C6H6N6O/c7-5(13)4-1-8-11-6(4)12-2-9-10-3-12/h1-3H,(H2,7,13)(H,8,11)
[InChIKey]

OFCNXPDARWKPPY-UHFFFAOYSA-N
[SMILES]

N1C=C(C(N)=O)C(N2C=NN=C2)=N1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

WGK 3
[HS Code ]

2933199050
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

3-(4H-1,2,4-Triazol-4-yl)-1H-pyrazole-4-carboxamide (Allopurinol EP Impurity C) is an impurity of Allopurinol (A547300).
[Uses]

An impurity of Allopurinol (A547300).
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