Cas no 663191-97-7 (Butanamide, 4,4,4-trifluoro-N-(3-methylphenyl)-3-oxo-)
663191-97-7 structure
Product Name:Butanamide, 4,4,4-trifluoro-N-(3-methylphenyl)-3-oxo-
CAS No:663191-97-7
MF:C11H10F3NO2
MW:245.197813510895
CID:1708070
PubChem ID:83398434
Update Time:2025-04-21
Butanamide, 4,4,4-trifluoro-N-(3-methylphenyl)-3-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Butanamide, 4,4,4-trifluoro-N-(3-methylphenyl)-3-oxo-
- 4,4,4-Trifluoro-3-oxo-N-M-tolyl-butyraMide
- AKOS023112867
- 663191-97-7
- 4,4,4-trifluoro-3-oxo-N-(m-tolyl)butanamide
- DB-218526
-
- Inchi： 1S/C11H10F3NO2/c1-7-3-2-4-8(5-7)15-10(17)6-9(16)11(12,13)14/h2-5H,6H2,1H3,(H,15,17)
- InChI Key： HUZIAPIMSQSLQT-UHFFFAOYSA-N
- SMILES： FC(C(CC(NC1C=CC=C(C)C=1)=O)=O)(F)F
Computed Properties
- Exact Mass: 245.0664
- Monoisotopic Mass: 245.06636305g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 302
- 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: 3.2
- Topological Polar Surface Area: 46.2?2
Experimental Properties
- PSA: 46.17
Butanamide, 4,4,4-trifluoro-N-(3-methylphenyl)-3-oxo- Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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