Cas no 192575-17-0 (1-(4-bromopyridin-3-yl)ethanone)
192575-17-0 structure
Product Name:1-(4-bromopyridin-3-yl)ethanone
CAS No:192575-17-0
MF:C7H6BrNO
MW:200.03264093399
CID:1385652
PubChem ID:23436844
Update Time:2025-04-20
1-(4-bromopyridin-3-yl)ethanone Chemical and Physical Properties
Names and Identifiers
-
- 1-(4-bromopyridin-3-yl)ethanone
- DA-31034
- SCHEMBL5700043
- AB64732
- 192575-17-0
-
- MDL： MFCD11847726
- Inchi： 1S/C7H6BrNO/c1-5(10)6-4-9-3-2-7(6)8/h2-4H,1H3
- InChI Key： LUDXKDMFATZDSK-UHFFFAOYSA-N
- SMILES： BrC1C=CN=CC=1C(C)=O
Computed Properties
- Exact Mass: 198.96328g/mol
- Monoisotopic Mass: 198.96328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 138
- 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: 1.2
- Topological Polar Surface Area: 30?2
1-(4-bromopyridin-3-yl)ethanone Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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