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4-(Methylthio)phenylboronic acid

4-(Methylthio)phenylboronic acid

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Catalog Number

ACM98546511

CAS Number

98546-51-1

Product Name

4-(Methylthio)phenylboronic acid

Structure

Category

Salt

Synonyms

4-THIOMETHYLPHENYLBORONIC ACID;4-THIOANISOLEBORONIC ACID;4-(METHYLSULFANYL)PHENYLBORONIC ACID;4-METHYLSULFANYL-BENZENEBORONIC ACID;4-(METHYLTHIO)BENZENEBORONIC ACID;4-(METHYLTHIO)PHENYLBORONIC ACID;4-(METHYLMERCAPTO)BENZENEBORONIC ACID;4-BORONOTHIOANISOLE

IUPAC Name

(4-methylsulfanylphenyl)boronic acid

Molecular Weight

168.03g/mol

Molecular Formula

C7H9BO2S

Canonical SMILES

B(C1=CC=C(C=C1)SC)(O)O

InChI

InChI=1S/C7H9BO2S/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5,9-10H,1H3

InChI Key

IVUHTLFKBDDICS-UHFFFAOYSA-N

Complexity

113

Covalently-Bonded Unit Count

1

Exact Mass

168.041631g/mol

Formal Charge

0

Heavy Atom Count

11

Monoisotopic Mass

168.041631g/mol

Rotatable Bond Count

2

MSDS

COA

Spec Sheet

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