Cas no 42772-87-2 (bis(6-bromopyridin-2-yl)methanone)
42772-87-2 structure
Product Name:bis(6-bromopyridin-2-yl)methanone
CAS No:42772-87-2
MF:C11H6Br2N2O
MW:341.986140727997
CID:2125953
PubChem ID:12462247
Update Time:2025-04-21
bis(6-bromopyridin-2-yl)methanone Chemical and Physical Properties
Names and Identifiers
-
- bis(6-bromopyridin-2-yl)methanone
- FAQKRQNOHLEVHR-UHFFFAOYSA-N
- di(6-bromo-2-pyridyl)ketone
- DA-05922
- SCHEMBL960010
- 42772-87-2
-
- Inchi： 1S/C11H6Br2N2O/c12-9-5-1-3-7(14-9)11(16)8-4-2-6-10(13)15-8/h1-6H
- InChI Key： FAQKRQNOHLEVHR-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(C(C2C=CC=C(N=2)Br)=O)=N1
Computed Properties
- Exact Mass: 341.88264Da
- Monoisotopic Mass: 339.88469Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 238
- 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: 3.8
- Topological Polar Surface Area: 42.9?2
bis(6-bromopyridin-2-yl)methanone Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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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
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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