99655-68-2

Basic information

• Product Name: 3-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE
• Synonyms: 1-(Benzenesulphonyl)-3-bromo-1H-indole;1-(Benzenesulfonyl)-3-broMoindole;3-Bromo-1H-indol-1-yl phenyl sulphone;3-bromo-2-(phenylsulfonyl)-1H-indole;1-BENZENESULFONYL-3-BROMO-1H-INDOLE;1-PHENYLSULPHONYL-3-BROMOINDOLE;3-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE;3-BROMO-1-(PHENYLSULFONYL)INDOLE
• CAS NO: 99655-68-2
• Molecular Formula: C₁₄H₁₀BrNO₂S
• Molecular Weight: 336.2
• Product Categories: Indoles and derivatives
• Mol File: 99655-68-2.mol
• Article Data: 19

Chemical Properties

• Melting Point: 122-126 °C(lit.)
• Boiling Point: 498 °C at 760 mmHg
• Flash Point: 255 °C
• Appearance: /Solid
• Density: 1.55 g/cm³
• Vapor Pressure: 4.73E-10mmHg at 25°C
• Refractive Index: 1.669
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• CAS DataBase Reference: 3-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE(99655-68-2)
• EPA Substance Registry System: 3-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE(99655-68-2)

Safety Data

• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 26-36/37/39
• WGK Germany: 3
• Hazardous Substances Data: 99655-68-2(Hazardous Substances Data)

Usage

General Description

3-Bromo-1-(phenylsulfonyl)-1H-indole is a chemical compound with the molecular formula C14H10BrNO2S. It is a brominated indole derivative with a phenylsulfonyl group attached to the 1-position. 3-BROMO-1-(PHENYLSULFONYL)-1H-INDOLE has potential applications in organic synthesis and medicinal chemistry. It may be used as a building block in the synthesis of other organic compounds, particularly those with indole or phenylsulfonyl moieties. Additionally, it may also have biological activity and could potentially be investigated for its pharmacological properties. Overall, 3-Bromo-1-(phenylsulfonyl)-1H-indole is a versatile chemical that may have various uses in the laboratory and pharmaceutical industry.

InChI:InChI=1/C14H10BrNO2S/c15-13-10-16(14-9-5-4-8-12(13)14)19(17,18)11-6-2-1-3-7-11/h1-10H

Upstream product

• 1484-27-1 3-bromoindole 
• 98-09-9 benzenesulfonyl chloride 
• 278593-17-2 1-(phenylsulfonyl)-1H-indole-3-carboxylic acid 
• 145887-95-2 3-bromo-1-phenylsulfonyl-2-phenylthioindole 
• 120-72-9 indole 
• 145887-97-4 3-bromo-2-phenylsulfinyl-1-phenylsulfonylindole 
• 40899-71-6 1-benzenesulfonylindole 

Downstream Products

• 129271-98-3 1-(phenylsulfonyl)-1H-indol-3-ylboronic acid 
• 77507-52-9 3-ethyl-1-(phenylsulfonyl)-1H-indole 
• 102210-77-5 4-<2-(1-(benzenesulfonyl)indolyl)>-2,7-dimethyl-2,6-octadiene 
• 102210-78-6 1-(1-Benzenesulfonyl-1H-indol-2-yl)-3-chloro-3-methyl-butan-1-one 
• 102210-82-2 1-(1-Benzenesulfonyl-1H-indol-3-yl)-3-methyl-butan-1-one 
• 103431-10-3 1-Benzenesulfonyl-2-(3-methyl-but-2-enyl)-1H-indole 
• 102210-81-1 1-(benzenesulfonyl)-3-(α-hydroxyprenyl)indole 
• 40900-03-6 1-(benzenesulfonyl)-2-lithioindole 
• 17771-42-5 3-(3-methyl-2-butenyl)indole 
• 321896-77-9 2,3-diphenyl-1-(phenylsulfonyl)indole 
• 3469-20-3 2,3-diphenyl-1H-indole 
• 1025936-30-4 methanesulfonic acid 2-(1-benzenesulfonyl-1H-indol-3-yl)-1-methyl-2-oxo-ethyl ester 
• 476682-67-4 1-(1-benzenesulfonyl-1H-indol-3-yl)-2-hydroxy-propan-1-one 
• 205238-44-4 Methanesulfonic acid (R)-2-(1-benzenesulfonyl-1H-indol-3-yl)-propyl ester 

Relevant articles and documents

Rationally designed N-phenylsulfonylindoles as a tool for the analysis of the non-basic 5-HT6R ligands binding mode

Among all of the monoaminergic receptors, the 5-HT6R has the highest number of non-basic ligands (approximately 5% of compounds stored in 25th version of ChEMBL database have the strongest basic pKa below 5, calculated using the Instant JChem c

Synthesis and DNA binding of 6-(alkylamino)indolo[1,2-b][2,7]naphthyridine-5,12-quinones

We describe the synthesis of eight novel putative mono– and bis–DNA intercalators from a common precursor, 6-bromoindolo[1,2-b][2,7]naphthyridine-5,12-dione. Of these new indoloquinones, our data indicate that two are most likely DNA mono–intercalators, but weaker than ethidium bromide, and two others are DNA bis–intercalators. Our indoloquinones are inactive against mammalian topoisomerase II.

Decarboxylative halogenation of indolecarboxylic acids using hypervalent iodine(III) reagent and its application to the synthesis of polybromoindoles

Hypervalent iodine mediated decarboxylative halogenation of indoledicarboxylic acid derivatives was studied. The treatment of 1-methylindole-2,3-dicarboxylic acid with phenyliodine diacetate (PIDA) in the presence of lithium bromide gave 1-methyl-3,3-brom