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(Q72495596)
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English
2-(4-Methylpiperazino)pyrimidine-5-boronic acid pinacol ester
chemical compound
2-(4-Methylpiperazin-1-yl)pyrimidine-5-boronic acid pinacol ester
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
304.20705644
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₅BN₄O₂
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canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(N=C2)N3CCN(CC3)C
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Identifiers
InChI
InChI=1S/C15H25BN4O2/c1-14(2)15(3,4)22-16(21-14)12-10-17-13(18-11-12)20-8-6-19(5)7-9-20/h10-11H,6-9H2,1-5H3
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InChIKey
LGIDGOSYDQTQDO-UHFFFAOYSA-N
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CAS Registry Number
942922-07-8
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PubChem CID
16414228
1 reference
matched by identifier from
InChIKey
InChIKey
LGIDGOSYDQTQDO-UHFFFAOYSA-N
UniChem compound ID
24727877
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30585971
1 reference
matched by identifier from
InChIKey
InChIKey
LGIDGOSYDQTQDO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80536736
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