Cas no 51081-76-6 (2-Propen-1-one, 3-[5-(4-bromophenyl)-2-thienyl]-1-phenyl-)
![2-Propen-1-one, 3-[5-(4-bromophenyl)-2-thienyl]-1-phenyl- structure](https://ossimg.kuujia.com/scimg/51500/51081-76-6x500.png)
51081-76-6 structure
Product Name:2-Propen-1-one, 3-[5-(4-bromophenyl)-2-thienyl]-1-phenyl-
CAS No:51081-76-6
MF:C19H13BrOS
MW:369.274923086166
CID:363317
PubChem ID:71366313
Update Time:2025-04-19
2-Propen-1-one, 3-[5-(4-bromophenyl)-2-thienyl]-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-one, 3-[5-(4-bromophenyl)-2-thienyl]-1-phenyl-
- 3-[5-(4-bromophenyl)thiophen-2-yl]-1-phenylprop-2-en-1-one
- DTXSID10789677
- 51081-76-6
-
- Inchi： 1S/C19H13BrOS/c20-16-8-6-15(7-9-16)19-13-11-17(22-19)10-12-18(21)14-4-2-1-3-5-14/h1-13H
- InChI Key： MRYSXLHSDQIUQV-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)C1=CC=C(C=CC(C2C=CC=CC=2)=O)S1
Computed Properties
- Exact Mass: 367.98709
- Monoisotopic Mass: 367.98705g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 394
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 5.8
- Topological Polar Surface Area: 45.3?2
Experimental Properties
- PSA: 17.07
2-Propen-1-one, 3-[5-(4-bromophenyl)-2-thienyl]-1-phenyl- Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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