Cas no 123892-57-9 (7-Methyl-1-tosyl-1H-indole)
7-Methyl-1-tosyl-1H-indole structure
Product Name:7-Methyl-1-tosyl-1H-indole
CAS No:123892-57-9
MF:C16H15NO2S
MW:285.36080288887
CID:2760213
PubChem ID:14567394
Update Time:2025-04-21
7-Methyl-1-tosyl-1H-indole Chemical and Physical Properties
Names and Identifiers
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- 7-methyl-1-(4-methylbenzenesulfonyl)-1H-indole
- DTXSID70561719
- 7-Methyl-1-tosyl-1H-indole
- 123892-57-9
- 7-Methyl-1-(4-methylbenzene-1-sulfonyl)-1H-indole
-
- Inchi： 1S/C16H15NO2S/c1-12-6-8-15(9-7-12)20(18,19)17-11-10-14-5-3-4-13(2)16(14)17/h3-11H,1-2H3
- InChI Key： NBJBSZXTULZDES-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(N1C=CC2=CC=CC(C)=C12)(=O)=O
Computed Properties
- Exact Mass: 285.08234989Da
- Monoisotopic Mass: 285.08234989Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 434
- 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
- Topological Polar Surface Area: 47.5?2
7-Methyl-1-tosyl-1H-indole Related Literature
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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