Cas no 869335-69-3 (1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]-)
![1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]- structure](https://ossimg.kuujia.com/scimg/869500/869335-69-3x500.png)
869335-69-3 structure
Product Name:1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]-
CAS No:869335-69-3
MF:C14H10ClFN2O2S
MW:324.757804393768
CID:719026
PubChem ID:49759078
Update Time:2025-04-19
1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]-
- 4-chloro-3-fluoro-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine
- 1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]
- 4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine
- HBKJJZGSUKNDSI-UHFFFAOYSA-N
- 4-Chloro-3-fluoro-1-(4-methylbenzene-1-sulfonyl)-1H-pyrrolo[2,3-b]pyridine
- 1H-PYRROLO[2,3-B]PYRIDINE, 4-CHLORO-3-FLUORO-1-[(4-METHYLPHENYL)SULFONYL]-
- 869335-69-3
- SCHEMBL2885747
- 4-Chloro-3-fluoro-1-tosyl-1H-pyrrolo[2,3-b]pyridine
- DTXSID60678007
-
- Inchi： 1S/C14H10ClFN2O2S/c1-9-2-4-10(5-3-9)21(19,20)18-8-12(16)13-11(15)6-7-17-14(13)18/h2-8H,1H3
- InChI Key： HBKJJZGSUKNDSI-UHFFFAOYSA-N
- SMILES： ClC1C=CN=C2C=1C(=CN2S(C1C=CC(C)=CC=1)(=O)=O)F
Computed Properties
- Exact Mass: 324.01400
- Monoisotopic Mass: 324.014
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 476
- 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
- Topological Polar Surface Area: 60.3A^2
- XLogP3: 3.6
Experimental Properties
- Density: 1.47
- Boiling Point: 486.4°C at 760 mmHg
- Flash Point: 248°C
- Refractive Index: 1.653
- PSA: 60.34000
- LogP: 4.45500
1H-Pyrrolo[2,3-b]pyridine,4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]- Related Literature
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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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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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