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616880-14-9

616880-14-9 Structure

616880-14-9 Structure
IdentificationBack Directory
[Name]

4-METHANESULFONYLAMINOPHENYLBORONIC ACID, PINACOL ESTER
[CAS]

616880-14-9
[Synonyms]

SKL737
Methanesulfona
4-Methylsulfonylaminophenylboronic acid,pinacol ester
4-(Methylsulfonamido)phenylboronic acid pinacol ester
4-METHANESULFONYLAMINOPHENYLBORONIC ACID, PINACOL ESTER
4-(MethanesulfonaMido)phenylboronic acid pinacol ester, 97%
4-(Methanesulfonylamino)phenylboronic acid pinacol ester 97%
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]met...
2-[4-(Methanesulfonylamino)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
N-(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-PHENYL)METHANESULFONAMIDE
N-(Methylsulfonyl)-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)benzenaMine
Methanesulfonamide, N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
[Molecular Formula]

C13H20BNO4S
[MDL Number]

MFCD05663876
[MOL File]

616880-14-9.mol
[Molecular Weight]

297.18
Chemical PropertiesBack Directory
[Melting point ]

197-201 °C(lit.)
[Boiling point ]

414.2±47.0 °C(Predicted)
[density ]

1.19±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

powder to crystal
[pka]

8.45±0.10(Predicted)
[color ]

White to Almost white
[InChI]

1S/C13H20BNO4S/c1-12(2)13(3,4)19-14(18-12)10-6-8-11(9-7-10)15-20(5,16)17/h6-9,15H,1-5H3
[InChIKey]

NPSPNWPZDXQYAC-UHFFFAOYSA-N
[SMILES]

CC1(C)OB(OC1(C)C)c2ccc(NS(C)(=O)=O)cc2
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[Safety Statements ]

36
[WGK Germany ]

3
[HS Code ]

2931900090
[Storage Class]

13 - Non Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

2-(4-Methylsulfonylaminophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is a reagent for the synthesis of selective irreversible BMX kinase inhibitor BMX-IN-1 with antitumor activity.
Spectrum DetailBack Directory
[Spectrum Detail]

4-METHANESULFONYLAMINOPHENYLBORONIC ACID, PINACOL ESTER(616880-14-9)1HNMR
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