Cas no 123525-89-3 (1-(2,2,2-Trifluoroethoxy)-2-methoxyethane)
123525-89-3 structure
Product Name:1-(2,2,2-Trifluoroethoxy)-2-methoxyethane
CAS No:123525-89-3
MF:C5H9F3O2
MW:158.118972539902
CID:2901702
PubChem ID:54230690
Update Time:2025-04-21
1-(2,2,2-Trifluoroethoxy)-2-methoxyethane Chemical and Physical Properties
Names and Identifiers
-
- MFCD29986785
- Ethane, 1,1,1-trifluoro-2-(2-methoxyethoxy)-
- 2-(2,2,2-Trifluoroethoxy)ethyl methyl ether
- QJATYOOHKWMKNP-UHFFFAOYSA-N
- SCHEMBL3306271
- 1-(2,2,2-Trifluoroethoxy)-2-methoxyethane
- 123525-89-3
-
- Inchi： 1S/C5H9F3O2/c1-9-2-3-10-4-5(6,7)8/h2-4H2,1H3
- InChI Key： QJATYOOHKWMKNP-UHFFFAOYSA-N
- SMILES： FC(COCCOC)(F)F
Computed Properties
- Exact Mass: 158.05546401Da
- Monoisotopic Mass: 158.05546401Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 81.5
- 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
- Topological Polar Surface Area: 18.5?2
1-(2,2,2-Trifluoroethoxy)-2-methoxyethane Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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