ChemicalBook--->CAS DataBase List--->850567-97-4

850567-97-4

850567-97-4 Structure

850567-97-4 Structure
IdentificationBack Directory
[Name]

2-(METHYLSULFINYL)PHENYLBORONIC ACID
[CAS]

850567-97-4
[Synonyms]

M4476G1
1-Borono-2-(methylsulphinyl)benzene
2-(METHYLSULFINYL)PHENYLBORONIC ACID
2-(Methylsulphonyl)phenylboronicacid
(2-Methanesulfinylphenyl)boronic acid
2-(METHYLSULPHINYL)BENZENEBORONIC ACID
2-(Methylsulfinyl)benzeneboronic acid, 97%
Boronic acid, B-[2-(methylsulfinyl)phenyl]-
[Molecular Formula]

C7H9BO3S
[MDL Number]

MFCD03095261
[MOL File]

850567-97-4.mol
[Molecular Weight]

184.02
Chemical PropertiesBack Directory
[Melting point ]

118-122°C
[Boiling point ]

440.5±47.0 °C(Predicted)
[density ]

1.37±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[pka]

8.46±0.58(Predicted)
[color ]

white
[Water Solubility ]

Slightly soluble in water.
[InChI]

1S/C7H9BO3S/c1-12(11)7-5-3-2-4-6(7)8(9)10/h2-5,9-10H,1H3
[InChIKey]

PHORKVSBWZGTEX-UHFFFAOYSA-N
[SMILES]

OB(O)C1=C(S(C)=O)C=CC=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37/39
[WGK Germany ]

WGK 3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29319090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

It is a useful intermediate in pharmaceutical intermediate. Boronic Acids are important chemical building blocks employed in cross coupling reactions. The ability of boronic acids to reversibly bind diol functional groups has been utilized for fluorescent detection of saccharides. The compound Bortezomib utilizes the boronic acid for its proteasome inhibitory effect.
Spectrum DetailBack Directory
[Spectrum Detail]

2-(METHYLSULFINYL)PHENYLBORONIC ACID(850567-97-4)1HNMR
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