CAS
458532-97-3 Purity
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458532-97-3 Purity
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3-Formyl-2-methoxy-5-methylphenylboronic acid
CAS
480424-55-3
Catalog Number
ACM480424553-1
Category
Boronic Acids
Molecular Weight
193.99g/mol
Molecular Formula
C9H11BO4
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Specification
IUPAC Name
(3-formyl-2-methoxy-5-methylphenyl)boronic acid
Canonical SMILES
B(C1=CC(=CC(=C1OC)C=O)C)(O)O
InChI
InChI=1S/C9H11BO4/c1-6-3-7(5-11)9(14-2)8(4-6)10(12)13/h3-5,12-13H,1-2H3
InChI Key
WDUHXJSEZPXEFU-UHFFFAOYSA-N
Complexity
197
Covalently-Bonded Unit Count
1
Exact Mass
194.075039g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
14
Monoisotopic Mass
194.075039g/mol
Rotatable Bond Count
3
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