Cas no 36081-80-8 (1,3-Propanedione, 1-(2-bromophenyl)-3-phenyl-)
36081-80-8 structure
Product Name:1,3-Propanedione, 1-(2-bromophenyl)-3-phenyl-
CAS No:36081-80-8
MF:C15H11BrO2
MW:303.150643587112
CID:1474343
PubChem ID:10685823
Update Time:2025-04-20
1,3-Propanedione, 1-(2-bromophenyl)-3-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Propanedione, 1-(2-bromophenyl)-3-phenyl-
- 1-(2-bromophenyl)-3-phenyl-1,3-Propanedione
- 1-(2'-bromophenyl)-3-phenylpropane-1,3-dione
- DA-31446
- 36081-80-8
- SCHEMBL3671416
- 2-bromo-dibenzoylmethane
-
- Inchi： 1S/C15H11BrO2/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-9H,10H2
- InChI Key： FOYARDQRQXBRJQ-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1C(CC(C1C=CC=CC=1)=O)=O
Computed Properties
- Exact Mass: 301.99423
- Monoisotopic Mass: 301.99424g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 308
- 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: 34.1?2
Experimental Properties
- PSA: 34.14
1,3-Propanedione, 1-(2-bromophenyl)-3-phenyl- Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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5. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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