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39243-02-2

Name Pyrazolam
CAS 39243-02-2
EINECS(EC#) 200-258-5
Molecular Formula C16H12BrN5
MDL Number MFCD26954579
Molecular Weight 354.2
MOL File 39243-02-2.mol

Chemical Properties

Melting point  253-255 °C
Boiling point  544.4±60.0 °C(Predicted)
density  1.62±0.1 g/cm3(Predicted)
storage temp.  -20°C
solubility  DMF: 30 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 20 mg/ml; Ethanol: 10 mg/ml; Methanol: 1 mg/ml
form  A crystalline solid
pka 2.18±0.40(Predicted)
InChI InChI=1S/C16H12BrN5/c1-10-20-21-15-9-19-16(13-4-2-3-7-18-13)12-8-11(17)5-6-14(12)22(10)15/h2-8H,9H2,1H3
InChIKey BGRWSFIQQPVEML-UHFFFAOYSA-N
SMILES N12C(C)=NN=C1CN=C(C1=NC=CC=C1)C1=CC(Br)=CC=C12

Safety Data

RIDADR  UN 1648 3 / PGII

Hazard Information

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