Cas no 1979-24-4 (Acetic acid,2-(2-chloro-4,6-difluorophenoxy)-)
1979-24-4 structure
Product Name:Acetic acid,2-(2-chloro-4,6-difluorophenoxy)-
CAS No:1979-24-4
MF:C8H5ClF2O3
MW:222.573308706284
CID:227026
PubChem ID:223064
Update Time:2025-04-19
Acetic acid,2-(2-chloro-4,6-difluorophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid,2-(2-chloro-4,6-difluorophenoxy)-
- 2-(2-chloro-4,6-difluorophenoxy)acetic acid
- (2-Chlor-4,6-difluor-phenoxy)-essigsaeure
- (2-chloro-4,6-difluorophenoxy)acetic acid
- (2-chloro-4,6-difluoro-phenoxy)-acetic acid
- AC1L5C9X
- AC1Q3MHF
- AG-K-86948
- AR-1A2191
- CTK4E2356
- KST-1A2873
- NSC10223
- NSC-10223
- DTXSID10278819
- 1979-24-4
-
- Inchi： 1S/C8H5ClF2O3/c9-5-1-4(10)2-6(11)8(5)14-3-7(12)13/h1-2H,3H2,(H,12,13)
- InChI Key： SZCLFLYFEMIZTK-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=C(C=1OCC(=O)O)F)F
Computed Properties
- Exact Mass: 221.98955
- Monoisotopic Mass: 221.989528
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 215
- 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
- Topological Polar Surface Area: 46.5
- XLogP3: 2.3
Experimental Properties
- Density: 1.535
- Boiling Point: 317.7°C at 760 mmHg
- Flash Point: 146°C
- Refractive Index: 1.519
- PSA: 46.53
Acetic acid,2-(2-chloro-4,6-difluorophenoxy)- Related Literature
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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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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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