Cas no 88460-71-3 (2-Butenoic acid, 4-(4-acetylphenyl)-4-oxo-)
88460-71-3 structure
Product Name:2-Butenoic acid, 4-(4-acetylphenyl)-4-oxo-
CAS No:88460-71-3
MF:C12H10O4
MW:218.205403804779
CID:632014
PubChem ID:71318105
Update Time:2025-04-19
2-Butenoic acid, 4-(4-acetylphenyl)-4-oxo- Chemical and Physical Properties
Names and Identifiers
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- 2-Butenoic acid, 4-(4-acetylphenyl)-4-oxo-
- 4-(4-acetylphenyl)-4-oxobut-2-enoic acid
- DTXSID70748280
- 88460-71-3
-
- Inchi： 1S/C12H10O4/c1-8(13)9-2-4-10(5-3-9)11(14)6-7-12(15)16/h2-7H,1H3,(H,15,16)
- InChI Key： FKOACGYKFYTUKV-UHFFFAOYSA-N
- SMILES： O=C(C)C1C=CC(C(C=CC(=O)O)=O)=CC=1
Computed Properties
- Exact Mass: 218.05790880g/mol
- Monoisotopic Mass: 218.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 322
- 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: 1.2
- Topological Polar Surface Area: 71.4?2
2-Butenoic acid, 4-(4-acetylphenyl)-4-oxo- 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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Jason Wan Lab Chip, 2020,20, 4528-4538
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
88460-71-3 (2-Butenoic acid, 4-(4-acetylphenyl)-4-oxo-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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