Cas no 260417-56-9 (Methanone,(2-bromo-4-pyridinyl)-3-pyridinyl-)
260417-56-9 structure
Product Name:Methanone,(2-bromo-4-pyridinyl)-3-pyridinyl-
CAS No:260417-56-9
MF:C11H7BrN2O
MW:263.090081453323
CID:247284
PubChem ID:18679657
Update Time:2025-04-19
Methanone,(2-bromo-4-pyridinyl)-3-pyridinyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone,(2-bromo-4-pyridinyl)-3-pyridinyl-
- (2-bromopyridin-4-yl)-pyridin-3-ylmethanone
- (2-bromopyridin-4-yl)(pyridin-3-yl)methanone
- 260417-56-9
- SCHEMBL7228256
- FT-0604605
- (2-BROMO-4-PYRIDINYL)-3-PYRIDINYL-METHANONE
- DTXSID30595550
- (2-bromopyridin-4-yl)pyridin-3-ylmethanone
-
- Inchi： 1S/C11H7BrN2O/c12-10-6-8(3-5-14-10)11(15)9-2-1-4-13-7-9/h1-7H
- InChI Key： IOVJKGWSRSFDRT-UHFFFAOYSA-N
- SMILES： BrC1C=C(C=CN=1)C(C1C=NC=CC=1)=O
Computed Properties
- Exact Mass: 261.97421
- Monoisotopic Mass: 261.97418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 235
- 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: 2.1
- Topological Polar Surface Area: 42.8?2
Experimental Properties
- PSA: 42.85
Methanone,(2-bromo-4-pyridinyl)-3-pyridinyl- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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