Cas no 835882-03-6 (Methanone, (2-amino-5-bromo-3-pyridinyl)phenyl-)
835882-03-6 structure
Product Name:Methanone, (2-amino-5-bromo-3-pyridinyl)phenyl-
CAS No:835882-03-6
MF:C12H9BrN2O
MW:277.116661787033
CID:1815685
PubChem ID:59654920
Update Time:2025-04-21
Methanone, (2-amino-5-bromo-3-pyridinyl)phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (2-amino-5-bromo-3-pyridinyl)phenyl-
- DB-420047
- (2-amino-5-bromo-3-pyridyl)-phenylketone
- 835882-03-6
- SCHEMBL1516765
- (2-Amino-5-bromo-3-pyridinyl)phenylmethanone
- WXAIPMSLVXOMFR-UHFFFAOYSA-N
- (2-amino-5-bromo-pyridin-3-yl)-phenyl-methanone
-
- Inchi： 1S/C12H9BrN2O/c13-9-6-10(12(14)15-7-9)11(16)8-4-2-1-3-5-8/h1-7H,(H2,14,15)
- InChI Key： WXAIPMSLVXOMFR-UHFFFAOYSA-N
- SMILES： BrC1=CN=C(C(=C1)C(C1C=CC=CC=1)=O)N
Computed Properties
- Exact Mass: 275.98983g/mol
- Monoisotopic Mass: 275.98983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 253
- 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: 3.1
- Topological Polar Surface Area: 56?2
Methanone, (2-amino-5-bromo-3-pyridinyl)phenyl- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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