Cas no 955403-60-8 (Benzenepropanal, 2-Methyl-5-(trifluoroMethyl)-)
955403-60-8 structure
Product Name:Benzenepropanal, 2-Methyl-5-(trifluoroMethyl)-
CAS No:955403-60-8
MF:C11H11F3O
MW:216.199653863907
CID:832803
PubChem ID:57659602
Update Time:2025-04-19
Benzenepropanal, 2-Methyl-5-(trifluoroMethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenepropanal, 2-Methyl-5-(trifluoroMethyl)-
- 3-[2-Methyl-5-(trifluoromethyl)phenyl]propanal
- WDBGVZFQAVNIDZ-UHFFFAOYSA-N
- 3-(2-methyl-5-(trifluoromethyl)phenyl)propanal
- SCHEMBL8226773
- Benzenepropanal,2-methyl-5-(trifluoromethyl)-
- starbld0047829
- 955403-60-8
-
- Inchi： 1S/C11H11F3O/c1-8-4-5-10(11(12,13)14)7-9(8)3-2-6-15/h4-7H,2-3H2,1H3
- InChI Key： WDBGVZFQAVNIDZ-UHFFFAOYSA-N
- SMILES： FC(C1C=CC(C)=C(C=1)CCC=O)(F)F
Computed Properties
- Exact Mass: 216.07619946g/mol
- Monoisotopic Mass: 216.07619946g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 212
- 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: 17.1?2
Benzenepropanal, 2-Methyl-5-(trifluoroMethyl)- Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
955403-60-8 (Benzenepropanal, 2-Methyl-5-(trifluoroMethyl)-) Related Products
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