3-chloro-5-(dimethylcarbamoyl)benzeneboronic acid

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Catalog Number

ACMA00015055

Product Name

3-chloro-5-(dimethylcarbamoyl)benzeneboronic acid

Category

Salt

IUPAC Name

[3-chloro-5-(dimethylcarbamoyl)phenyl]boronic acid

Molecular Weight

227.45g/mol

Molecular Formula

C9H11BClNO3

Canonical SMILES

B(C1=CC(=CC(=C1)Cl)C(=O)N(C)C)(O)O

InChI

InChI=1S/C9H11BClNO3/c1-12(2)9(13)6-3-7(10(14)15)5-8(11)4-6/h3-5,14-15H,1-2H3

InChI Key

CBWMBTZDVFPIKS-UHFFFAOYSA-N

Complexity

237

Covalently-Bonded Unit Count

Exact Mass

227.052051g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

227.052051g/mol

Rotatable Bond Count

MSDS

COA

Spec Sheet

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