Cas no 648896-54-2 (8-Quinolinol, 7-bromo-5-(3,5-difluorophenyl)-)
648896-54-2 structure
Product Name:8-Quinolinol, 7-bromo-5-(3,5-difluorophenyl)-
CAS No:648896-54-2
MF:C15H8BrF2NO
MW:336.130929946899
CID:413205
PubChem ID:57939269
Update Time:2025-04-19
8-Quinolinol, 7-bromo-5-(3,5-difluorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 8-Quinolinol, 7-bromo-5-(3,5-difluorophenyl)-
- 7-bromo-5-(3,5-difluorophenyl)quinolin-8-ol
- 648896-54-2
- DTXSID60728354
- SCHEMBL8344547
-
- Inchi: 1S/C15H8BrF2NO/c16-13-7-12(8-4-9(17)6-10(18)5-8)11-2-1-3-19-14(11)15(13)20/h1-7,20H
- InChI Key: GLUPGXJEEKNGDU-UHFFFAOYSA-N
- SMILES: BrC1=C(C2C(=CC=CN=2)C(=C1)C1C=C(C=C(C=1)F)F)O
Computed Properties
- Exact Mass: 334.97574
- Monoisotopic Mass: 334.97573g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 336
- 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: 4.4
- Topological Polar Surface Area: 33.1?2
Experimental Properties
- PSA: 33.12
8-Quinolinol, 7-bromo-5-(3,5-difluorophenyl)- Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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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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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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