Cas no 50594-77-9 (3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl acetate)
![3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl acetate structure](https://ossimg.kuujia.com/scimg/51000/50594-77-9x500.png)
50594-77-9 structure
Product Name:3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl acetate
CAS No:50594-77-9
MF:C15H10ClF3O3
MW:330.686314105988
CID:933964
PubChem ID:93253
Update Time:2025-04-19
3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl acetate Chemical and Physical Properties
Names and Identifiers
-
- 3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl acetate
- [3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl] acetate
- 2-Chlor-4-trifluormethyl-3'-acetoxydiphenylether
- 2-Chloro-1-(3-acetoxyphenoxy)-4-(trifluoromethyl)benzene
- 2-Chloro-4-trifluoromethyl-3'-acetoxydiphenyl ether
- 3-(2-Chloro-4-(trifluoromethyl)phenoxy)phenol acetate
- 3-(2-Chloro-4-(trifluoromethyl)phenoxy)phenyl acetate
- AC1L3PTV
- EINECS 256-635-0
- Phenol, 3-(2-chloro-4-(trifluoromethyl)phenoxy)-, acetate
- Phenol, 3-[2-chloro-4-(trifluoromethyl)phenoxy]-, acetate
- DB-262068
- UNII-7T2IS4PR1X
- KNFRYRRZMRETJX-UHFFFAOYSA-N
- DTXSID7028019
- 7T2IS4PR1X
- 50594-77-9
- Phenol, 3-(2-chloro-4-(trifluoromethyl)phenoxy)-, 1-acetate
- 3-(2-Chloro-4-(trifluoromethyl)phenoxy)phenol 1-acetate
- M-((2-CHLORO-.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-P-TOLYL)OXY)PHENYL ACETATE
- Q27268811
- NS00004714
-
- Inchi： 1S/C15H10ClF3O3/c1-9(20)21-11-3-2-4-12(8-11)22-14-6-5-10(7-13(14)16)15(17,18)19/h2-8H,1H3
- InChI Key： KNFRYRRZMRETJX-UHFFFAOYSA-N
- SMILES： ClC1C=C(C(F)(F)F)C=CC=1OC1C=CC=C(C=1)OC(C)=O
Computed Properties
- Exact Mass: 330.0271
- Monoisotopic Mass: 330.0270564g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 389
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.7
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 1.4003 (estimate)
- PSA: 35.53
3-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl acetate Related Literature
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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