Cas no 917951-63-4 (Propanoic acid, 3,3,3-trifluoro-2,2-bis(trifluoromethyl)-)
917951-63-4 structure
Product Name:Propanoic acid, 3,3,3-trifluoro-2,2-bis(trifluoromethyl)-
CAS No:917951-63-4
MF:C5HF9O2
MW:264.045873403549
CID:781440
PubChem ID:23367567
Update Time:2025-04-19
Propanoic acid, 3,3,3-trifluoro-2,2-bis(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 3,3,3-trifluoro-2,2-bis(trifluoromethyl)-
- 3,3,3-trifluoro-2,2-bis(trifluoromethyl)propanoic acid
- 917951-63-4
- SCHEMBL715969
- perfluoropivalic acid
- DTXSID00633413
- WZQRMZSLIAFYFJ-UHFFFAOYSA-N
-
- Inchi： 1S/C5HF9O2/c6-3(7,8)2(1(15)16,4(9,10)11)5(12,13)14/h(H,15,16)
- InChI Key： WZQRMZSLIAFYFJ-UHFFFAOYSA-N
- SMILES： FC(C(C(=O)O)(C(F)(F)F)C(F)(F)F)(F)F
Computed Properties
- Exact Mass: 263.98328273g/mol
- Monoisotopic Mass: 263.98328273g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 246
- 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: 2.9
- Topological Polar Surface Area: 37.3?2
Propanoic acid, 3,3,3-trifluoro-2,2-bis(trifluoromethyl)- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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