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5334-29-2

5334-29-2 Structure

5334-29-2 Structure
IdentificationBack Directory
[Name]

1-(4-CHLOROPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-OL
[CAS]

5334-29-2
[Synonyms]

AKOS BBS-00002065
IFLAB-BB F1386-0038
1-(4-CHLOROPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-OL
1-p-Chlorophenyl-4-hydroxypyrazolo[3,4-d]pyrimidine
1-(4-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one
4H-Pyrazolo[3,4-d]pyrimidin-4-one, 1-(4-chlorophenyl)-1,5-dihydro-
[Molecular Formula]

C11H7ClN4O
[MDL Number]

MFCD04971629
[MOL File]

5334-29-2.mol
[Molecular Weight]

246.65
Chemical PropertiesBack Directory
[Melting point ]

>300 °C
[Boiling point ]

491.5±25.0 °C(Predicted)
[density ]

1.58±0.1 g/cm3(Predicted)
[form ]

solid
[pka]

8.43±0.10(Predicted)
[InChI]

1S/C11H7ClN4O/c12-7-1-3-8(4-2-7)16-10-9(5-15-16)11(17)14-6-13-10/h1-6H,(H,13,14,17)
[InChIKey]

MHFVAIHAHMEWHA-UHFFFAOYSA-N
[SMILES]

Oc1ncnc2n(ncc12)-c3ccc(Cl)cc3
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
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