Cas no 855639-97-3 (8-Bromo-4-methyl-3-nitro-quinoline)
855639-97-3 structure
Product Name:8-Bromo-4-methyl-3-nitro-quinoline
CAS No:855639-97-3
MF:C10H7BrN2O2
MW:267.078781366348
CID:1057889
PubChem ID:131886009
Update Time:2025-04-20
8-Bromo-4-methyl-3-nitro-quinoline Chemical and Physical Properties
Names and Identifiers
-
- 8-Bromo-4-methyl-3-nitro-quinoline
- 855639-97-3
- 8-Bromo-4-methyl-3-nitroquinoline
- DB-318416
-
- Inchi: 1S/C10H7BrN2O2/c1-6-7-3-2-4-8(11)10(7)12-5-9(6)13(14)15/h2-5H,1H3
- InChI Key: QSDPPZLWWISNPZ-UHFFFAOYSA-N
- SMILES: BrC1=CC=CC2C1=NC=C(C=2C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 265.969
- Monoisotopic Mass: 265.969
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 256
- 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: 58.7?2
8-Bromo-4-methyl-3-nitro-quinoline 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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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