Cas no 70399-10-9 (1,5-Dihydro-1-(trifluoroacetyl)-2H-pyrrol-2-one)
70399-10-9 structure
Product Name:1,5-Dihydro-1-(trifluoroacetyl)-2H-pyrrol-2-one
CAS No:70399-10-9
MF:C6H4F3NO2
MW:179.096672058105
CID:867777
PubChem ID:12505877
Update Time:2025-04-19
1,5-Dihydro-1-(trifluoroacetyl)-2H-pyrrol-2-one Chemical and Physical Properties
Names and Identifiers
-
- 1-(2,2,2-trifluoroacetyl)-2H-pyrrol-5-one
- 2H-Pyrrol-2-one, 1,5-dihydro-1-(trifluoroacetyl)- (9CI)
- 1-(2,2,2-Trifluoroacetyl)-1H-pyrrol-2(5H)-one
- 70399-10-9
- DTXSID30500700
- 1-(Trifluoroacetyl)-1,5-dihydro-2H-pyrrol-2-one
- 1,5-DIHYDRO-1-(TRIFLUOROACETYL)-2H-PYRROL-2-ONE
- 1,5-Dihydro-1-(trifluoroacetyl)-2H-pyrrol-2-one
-
- Inchi: 1S/C6H4F3NO2/c7-6(8,9)5(12)10-3-1-2-4(10)11/h1-2H,3H2
- InChI Key: QKVQDTNZGFWMSG-UHFFFAOYSA-N
- SMILES: FC(C(N1C(C=CC1)=O)=O)(F)F
Computed Properties
- Exact Mass: 179.01941286g/mol
- Monoisotopic Mass: 179.01941286g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 256
- 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: 0.7
- Topological Polar Surface Area: 37.4?2
1,5-Dihydro-1-(trifluoroacetyl)-2H-pyrrol-2-one Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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