129271-98-3

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129271-98-3 Structure

Identification	More
[Name] 1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID
[CAS] 129271-98-3
[Synonyms] AKOS BRN-0396 1-PHENYLSULFONYLINDOLE-3-BORONIC ACID 1-PHENYLSULPHONYLINDOLE-3-BORONIC ACID 1-(PHENYLSULFONYL)-3-INDOLEBORONIC ACI& 1-(PHENYLSULFONYL)-3-INDOLEBORONIC ACID 1-phenylsulphonyl-1H-indol-ylboronicacid 1-(Phenylsulfonyl)-3-indolylboronic acid 1-Benzenesulfonyl-1H-indole-3-boronic acid [1-(benzenesulfonyl)indol-3-yl]boronic acid [1-(benzenesulfonyl)-3-indolyl]boronic acid 1-(Phenylsulfonyl)-1H-indole-3-boronic acid 3-(1-Benzenesulfonyl-1H-indole)boronic acid 1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID 1-(Phenylsulphonyl)-1H-indole-3-boronic acid 1-Phenylsulphonyl-1H-indol-yl-3-boronic acid 1-(Phenylsulfonyl)-3-indolylboronic acid 97% [1-(benzenesulfonyl)-1H-indol-3-yl]boronic acid 1-(Phenylsulphonyl)-1H-indole-3-boronic acid 97% Boronic acid, B-[1-(phenylsulfonyl)-1H-indol-3-yl]- 3-Borono-1-(phenylsulphonyl)-1H-indole, 3-Borono-1H-indol-1-yl phenyl sulphone 1-(Phenylsulfonyl)-1H-indol-3-ylboronic acid, 97%, May contain varying aMounts of anhydride 1-(Phenylsulfonyl)-1H-indol-3-ylboronic acid, May contain varying amounts of anhydride, 97%
[Molecular Formula] C14H12BNO4S
[MDL Number] MFCD02681892
[Molecular Weight] 301.13
[MOL File] 129271-98-3.mol

Chemical Properties	Back Directory
[Melting point ] 144 °C (dec.)(lit.)
[Boiling point ] 581.4±60.0 °C(Predicted)
[density ] 1.34±0.1 g/cm3(Predicted)
[storage temp. ] 2-8°C
[form ] powder
[pka] 7.98±0.30(Predicted)
[color ] Off-white to pale pink
[InChI] 1S/C14H12BNO4S/c17-15(18)13-10-16(14-9-5-4-8-12(13)14)21(19,20)11-6-2-1-3-7-11/h1-10,17-18H
[InChIKey] YKTZLHLBQGCFQX-UHFFFAOYSA-N
[SMILES] OB(O)c1cn(c2ccccc12)S(=O)(=O)c3ccccc3
[CAS DataBase Reference] 129271-98-3(CAS DataBase Reference)

Safety Data	Back Directory
[Hazard Codes ] Xi
[Risk Statements ] R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ] S24/25:Avoid contact with skin and eyes . S36:Wear suitable protective clothing . S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ] 3
[Hazard Note ] Irritant
[HS Code ] 2933299090
[Storage Class] 11 - Combustible Solids

Hazard Information	Back Directory
[Uses] 1-(Phenylsulfonyl)-3-indolylboronic acid can be used for chemoselective cross-coupling to form carbon-carbon bonds.

Spectrum Detail	Back Directory
[Spectrum Detail] 1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID(129271-98-3)¹HNMR 1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID(129271-98-3)IR

Well-known Reagent Company Product Information	Back Directory
[Acros Organics] 1-(phenylsulfonyl)-1H-indol-3-ylboronic acid(129271-98-3)
[Sigma Aldrich] 129271-98-3(sigmaaldrich)

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