Cas no 57073-26-4 (2-Propen-1-one, 3-(3-bromophenyl)-1-(4-methoxyphenyl)-)
57073-26-4 structure
Product Name:2-Propen-1-one, 3-(3-bromophenyl)-1-(4-methoxyphenyl)-
CAS No:57073-26-4
MF:C16H13BrO2
MW:317.177223920822
CID:346562
PubChem ID:70405179
Update Time:2025-04-19
2-Propen-1-one, 3-(3-bromophenyl)-1-(4-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-one, 3-(3-bromophenyl)-1-(4-methoxyphenyl)-
- 3-(3-bromophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
- 57073-26-4
- AKOS030239690
- DTXSID10741912
-
- Inchi： 1S/C16H13BrO2/c1-19-15-8-6-13(7-9-15)16(18)10-5-12-3-2-4-14(17)11-12/h2-11H,1H3
- InChI Key： RSWWQJNMOSIIDP-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1)C=CC(C1C=CC(=CC=1)OC)=O
Computed Properties
- Exact Mass: 316.00989
- Monoisotopic Mass: 316.00989g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 319
- 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: 4.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Propen-1-one, 3-(3-bromophenyl)-1-(4-methoxyphenyl)- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
57073-26-4 (2-Propen-1-one, 3-(3-bromophenyl)-1-(4-methoxyphenyl)-) Related Products
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