Cas no 189266-03-3 (7-Bromo-1-(4-methylbenzene-1-sulfonyl)-1H-indole)
189266-03-3 structure
Product Name:7-Bromo-1-(4-methylbenzene-1-sulfonyl)-1H-indole
CAS No:189266-03-3
MF:C15H12BrNO2S
MW:350.230281829834
CID:2786428
PubChem ID:57370910
Update Time:2025-04-21
7-Bromo-1-(4-methylbenzene-1-sulfonyl)-1H-indole Chemical and Physical Properties
Names and Identifiers
-
- 1H-INDOLE, 7-BROMO-1-[(4-METHYLPHENYL)SULFONYL]-
- 7-bromo-1-(4-methylbenzenesulfonyl)-1H-indole
- DTXCID50675560
- DB-207897
- SCHEMBL15392858
- DTXSID00724815
- 7-Bromo-1-[(4-methylphenyl)sulfonyl]-1h-indole
- 189266-03-3
- 7-Bromo-1-tosyl-1H-indole
- 7-Bromo-1-(4-methylbenzene-1-sulfonyl)-1H-indole
-
- Inchi： 1S/C15H12BrNO2S/c1-11-5-7-13(8-6-11)20(18,19)17-10-9-12-3-2-4-14(16)15(12)17/h2-10H,1H3
- InChI Key： LUMRKZWMFDOIQH-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC2C=CN(C=21)S(C1C=CC(C)=CC=1)(=O)=O
Computed Properties
- Exact Mass: 348.97721Da
- Monoisotopic Mass: 348.97721Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 439
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
- Topological Polar Surface Area: 47.5?2
7-Bromo-1-(4-methylbenzene-1-sulfonyl)-1H-indole Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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