Cas no 842132-49-4 (1-(4-ethylbenzyl)-5-bromopyridin-2(1H)-one)
842132-49-4 structure
Product Name:1-(4-ethylbenzyl)-5-bromopyridin-2(1H)-one
CAS No:842132-49-4
MF:C14H14BrNO
MW:292.17106294632
CID:2133297
PubChem ID:58242500
Update Time:2025-04-21
1-(4-ethylbenzyl)-5-bromopyridin-2(1H)-one Chemical and Physical Properties
Names and Identifiers
-
- 1-(4-ethylbenzyl)-5-bromopyridin-2(1H)-one
- DA-30993
- 5-Bromo-1-(4-ethylphenylmethyl)-1H-pyridin-2-one
- 842132-49-4
- XNRTXRHMYLODHR-UHFFFAOYSA-N
- AKOS013689302
- SCHEMBL147028
-
- Inchi： 1S/C14H14BrNO/c1-2-11-3-5-12(6-4-11)9-16-10-13(15)7-8-14(16)17/h3-8,10H,2,9H2,1H3
- InChI Key： XNRTXRHMYLODHR-UHFFFAOYSA-N
- SMILES： BrC1C=CC(N(C=1)CC1C=CC(=CC=1)CC)=O
Computed Properties
- Exact Mass: 291.02588Da
- Monoisotopic Mass: 291.02588Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 340
- 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: 3.1
- Topological Polar Surface Area: 20.3?2
1-(4-ethylbenzyl)-5-bromopyridin-2(1H)-one Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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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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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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