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(Q72482767)
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English
1H-Indazole-6-boronic acid pinacol ester
chemical compound
6-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-indazole
Indazole-6-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
244.13830818399998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₇BN₂O₂
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canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C=NN3
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Identifiers
InChI
InChI=1S/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)10-6-5-9-8-15-16-11(9)7-10/h5-8H,1-4H3,(H,15,16)
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InChIKey
YDWZPHAJTNZBEG-UHFFFAOYSA-N
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CAS Registry Number
861905-87-5
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PubChem CID
44119250
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matched by identifier from
InChIKey
InChIKey
YDWZPHAJTNZBEG-UHFFFAOYSA-N
UniChem compound ID
22741397
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID501006636
1 reference
matched by identifier from
InChIKey
InChIKey
YDWZPHAJTNZBEG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID601433503
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