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(Q72482947)
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English
Indole-7-boronic acid pinacol ester
chemical compound
7-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
243.14305921599998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₈BNO₂
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canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C3C(=CC=C2)C=CN3
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Identifiers
InChI
InChI=1S/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)11-7-5-6-10-8-9-16-12(10)11/h5-9,16H,1-4H3
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InChIKey
QAXZRSICOHKXML-UHFFFAOYSA-N
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CAS Registry Number
642494-37-9
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PubChem CID
11265016
1 reference
matched by identifier from
InChIKey
InChIKey
QAXZRSICOHKXML-UHFFFAOYSA-N
UniChem compound ID
23780186
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30460557
1 reference
matched by identifier from
InChIKey
InChIKey
QAXZRSICOHKXML-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20411376
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