CAS
765908-38-1 Purity
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765908-38-1 Purity
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3-Nitrophenylboronic acid pinacol ester
CAS
68716-48-3
Catalog Number
ACM68716483
Category
Boronic Esters
Molecular Weight
249.07g/mol
Molecular Formula
C12H16BNO4
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Specification
IUPAC Name
4,4,5,5-tetramethyl-2-(3-nitrophenyl)-1,3,2-dioxaborolane
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)[N+](=O)[O-]
InChI
InChI=1S/C12H16BNO4/c1-11(2)12(3,4)18-13(17-11)9-6-5-7-10(8-9)14(15)16/h5-8H,1-4H3
InChI Key
JWEAFTZTLIGAQU-UHFFFAOYSA-N
Complexity
324
Covalently-Bonded Unit Count
1
Exact Mass
249.117238g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
0
Heavy Atom Count
18
Monoisotopic Mass
249.117238g/mol
Rotatable Bond Count
1
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