Cas no 861905-44-4 (METHANONE, (4-BROMO-2-FLUOROPHENYL)-2-PYRIDINYL-)
861905-44-4 structure
Product Name:METHANONE, (4-BROMO-2-FLUOROPHENYL)-2-PYRIDINYL-
CAS No:861905-44-4
MF:C12H7BrFNO
MW:280.092485666275
CID:3468183
PubChem ID:57550813
Update Time:2025-04-21
METHANONE, (4-BROMO-2-FLUOROPHENYL)-2-PYRIDINYL- Chemical and Physical Properties
Names and Identifiers
-
- METHANONE, (4-BROMO-2-FLUOROPHENYL)-2-PYRIDINYL-
- 2-(4-Bromo-2-fluorobenzoyl)pyridine
- (4-Bromo-2-fluorophenyl)(2-pyridinyl)methanone
- SCHEMBL4215077
- 861905-44-4
- GWCQWHCYQDQNRC-UHFFFAOYSA-N
-
- Inchi： 1S/C12H7BrFNO/c13-8-4-5-9(10(14)7-8)12(16)11-3-1-2-6-15-11/h1-7H
- InChI Key： GWCQWHCYQDQNRC-UHFFFAOYSA-N
- SMILES： C(C1=CC=C(Br)C=C1F)(C1=NC=CC=C1)=O
Computed Properties
- Exact Mass: 278.96950Da
- Monoisotopic Mass: 278.96950Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 261
- 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: 30?2
METHANONE, (4-BROMO-2-FLUOROPHENYL)-2-PYRIDINYL- Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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