Cas no 834883-99-7 (Quinoline, 2-bromo-3-fluoro-)
Quinoline, 2-bromo-3-fluoro- structure
Product Name:Quinoline, 2-bromo-3-fluoro-
CAS No:834883-99-7
MF:C9H5BrFN
MW:226.04510474205
CID:670769
PubChem ID:12189463
Update Time:2025-04-19
Quinoline, 2-bromo-3-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- Quinoline, 2-bromo-3-fluoro-
- 2-Bromo-3-fluoroquinoline
- Quinoline,2-bromo-3-fluoro
- 834883-99-7
- DTXSID40479736
- AKOS024263636
- FT-0720987
-
- Inchi： 1S/C9H5BrFN/c10-9-7(11)5-6-3-1-2-4-8(6)12-9/h1-5H
- InChI Key： PIDNKIQMWIQDOX-UHFFFAOYSA-N
- SMILES： BrC1=C(C=C2C=CC=CC2=N1)F
Computed Properties
- Exact Mass: 224.95900
- Monoisotopic Mass: 224.95894g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 165
- 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: 3.3
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- PSA: 12.89000
- LogP: 3.13640
Quinoline, 2-bromo-3-fluoro- Related Literature
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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