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The molecular formula of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is C5HBrCl2N4.
The IUPAC name of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is 3-bromo-4,6-dichloro-2H-pyrazolo[3,4-d]pyrimidine.
The InChI of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is InChI=1S/C5HBrCl2N4/c6-2-1-3(7)9-5(8)10-4(1)12-11-2/h(H,9,10,11,12).
The InChIKey of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is XTVZOIZUAZZTOX-UHFFFAOYSA-N.
The canonical SMILES of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is C12=C(NN=C1N=C(N=C2Cl)Cl)Br.
The molecular weight of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is 267.90 g/mol.
The CAS number of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is 944902-17-4.
The DSSTox Substance ID of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is DTXSID50718264.
The XLogP3-AA value of 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is 3.1.
Yes, 3-Bromo-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine is a canonicalized compound.
944901-59-1
944902-03-8
944902-13-0
944902-64-1
944902-87-8
944903-06-4
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