Cas no 657395-43-2 (Benzoic acid, 4-chloro-3-(trifluoromethyl)-, butyl ester)
657395-43-2 structure
Product Name:Benzoic acid, 4-chloro-3-(trifluoromethyl)-, butyl ester
CAS No:657395-43-2
MF:C12H12ClF3O2
MW:280.670693397522
CID:1693061
Update Time:2024-09-02
Benzoic acid, 4-chloro-3-(trifluoromethyl)-, butyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-chloro-3-(trifluoromethyl)-, butyl ester
- Butyl 4-chloro-3-(trifluoromethyl)benzoate
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- Inchi： 1S/C12H12ClF3O2/c1-2-3-6-18-11(17)8-4-5-10(13)9(7-8)12(14,15)16/h4-5,7H,2-3,6H2,1H3
- InChI Key： YYKMLSRNSHJWKU-UHFFFAOYSA-N
- SMILES： C(OCCCC)(=O)C1=CC=C(Cl)C(C(F)(F)F)=C1
Computed Properties
- Exact Mass: 280.04786
Experimental Properties
- Density: 1.262±0.06 g/cm3(Predicted)
- Boiling Point: 298.8±40.0 °C(Predicted)
- PSA: 26.3
Benzoic acid, 4-chloro-3-(trifluoromethyl)-, butyl ester Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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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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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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