Cas no 74123-20-9 (Methanol,1,1,1-trifluoro-, 1-acetate)
74123-20-9 structure
Product Name:Methanol,1,1,1-trifluoro-, 1-acetate
CAS No:74123-20-9
MF:C3H2F3O2
MW:127.041991710663
CID:555470
PubChem ID:7016352
Update Time:2025-04-19
Methanol,1,1,1-trifluoro-, 1-acetate Chemical and Physical Properties
Names and Identifiers
-
- Methanol,1,1,1-trifluoro-, 1-acetate
- 3,3,3-trifluoropropanoate
- TRIFLUOROMETHYLACETATE
- Methanol,trifluoro-,acetate (9CI)
- Trifluormethylacetat
- 74123-20-9
- DTXSID60426823
- AKOS024437801
- [4-(4-FLUORO-PHENYL)-PIPERAZIN-1-YL]-(1H-INDOL-2-YL)-ACETICACID
-
- Inchi： 1S/C3H3F3O2/c4-3(5,6)1-2(7)8/h1H2,(H,7,8)/p-1
- InChI Key： KSNKQSPJFRQSEI-UHFFFAOYSA-M
- SMILES： FC(CC(=O)[O-])(F)F
Computed Properties
- Exact Mass: 127.00100
- Monoisotopic Mass: 127.00068879g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 89.7
- 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: 1.5
- Topological Polar Surface Area: 40.1?2
Experimental Properties
- PSA: 40.13000
- LogP: -0.31130
Methanol,1,1,1-trifluoro-, 1-acetate Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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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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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
74123-20-9 (Methanol,1,1,1-trifluoro-, 1-acetate) Related Products
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