Cas no 538308-78-0 (3-Buten-2-one, 4-(ethylamino)-1,1,1-trifluoro-)
538308-78-0 structure
Product Name:3-Buten-2-one, 4-(ethylamino)-1,1,1-trifluoro-
CAS No:538308-78-0
MF:C8H8FNO
MW:153.153625488281
CID:939218
PubChem ID:2778456
Update Time:2025-04-19
3-Buten-2-one, 4-(ethylamino)-1,1,1-trifluoro- Chemical and Physical Properties
Names and Identifiers
-
- 3-Buten-2-one, 4-(ethylamino)-1,1,1-trifluoro-
- AKOS015956702
- 3-Fluoro-5-methylbenzamide
- JS-4468
- 518070-23-0
- DB-271528
- DTXSID10380946
- 3-Buten-2-one, 4-(ethylamino)-1,1,1-trifluoro-
- 538308-78-0
- SB75801
- Benzamide, 3-fluoro-5-methyl- (9CI)
- CS-0322999
- SCHEMBL2468003
- MFCD03094319
-
- Inchi： 1S/C8H8FNO/c1-5-2-6(8(10)11)4-7(9)3-5/h2-4H,1H3,(H2,10,11)
- InChI Key： LKMYINWONMOKMN-UHFFFAOYSA-N
- SMILES： FC1C=C(C(N)=O)C=C(C)C=1
Computed Properties
- Exact Mass: 153.058992041g/mol
- Monoisotopic Mass: 153.058992041g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 160
- 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: 1.3
- Topological Polar Surface Area: 43.1?2
3-Buten-2-one, 4-(ethylamino)-1,1,1-trifluoro- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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