Cas no 62935-20-0 (Propanoic acid, 3,3,3-trifluoro-2-(trifluoromethyl)-, 2-methylpropyl ester)
62935-20-0 structure
Product Name:Propanoic acid, 3,3,3-trifluoro-2-(trifluoromethyl)-, 2-methylpropyl ester
CAS No:62935-20-0
MF:C8H10F6O2
MW:252.154223918915
CID:428641
PubChem ID:2748421
Update Time:2025-04-19
Propanoic acid, 3,3,3-trifluoro-2-(trifluoromethyl)-, 2-methylpropyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 3,3,3-trifluoro-2-(trifluoromethyl)-, 2-methylpropyl ester
- 62935-20-0
- DTXSID70372726
- 2-methylpropyl 3,3,3-trifluoro-2-(trifluoromethyl)propanoate
-
- Inchi： 1S/C8H10F6O2/c1-4(2)3-16-6(15)5(7(9,10)11)8(12,13)14/h4-5H,3H2,1-2H3
- InChI Key： BPBMESDFXYWYOV-UHFFFAOYSA-N
- SMILES： FC(C(C(F)(F)F)C(=O)OCC(C)C)(F)F
Computed Properties
- Exact Mass: 252.0585
- Monoisotopic Mass: 252.05849853g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 228
- 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: 3.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Propanoic acid, 3,3,3-trifluoro-2-(trifluoromethyl)-, 2-methylpropyl ester Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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