Cas no 56096-94-7 (Benzene, 2-(chloromethyl)-1-[(4-chlorophenyl)thio]-4-fluoro-)
![Benzene, 2-(chloromethyl)-1-[(4-chlorophenyl)thio]-4-fluoro- structure](https://ossimg.kuujia.com/scimg/56500/56096-94-7x500.png)
56096-94-7 structure
Product Name:Benzene, 2-(chloromethyl)-1-[(4-chlorophenyl)thio]-4-fluoro-
CAS No:56096-94-7
MF:C13H9Cl2FS
MW:287.179963827133
CID:349865
PubChem ID:71444846
Update Time:2025-04-19
Benzene, 2-(chloromethyl)-1-[(4-chlorophenyl)thio]-4-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-(chloromethyl)-1-[(4-chlorophenyl)thio]-4-fluoro-
- 2-(chloromethyl)-1-(4-chlorophenyl)sulfanyl-4-fluorobenzene
- 56096-94-7
- 2-(Chloromethyl)-1-[(4-chlorophenyl)sulfanyl]-4-fluorobenzene
- DTXSID80853596
-
- Inchi： 1S/C13H9Cl2FS/c14-8-9-7-11(16)3-6-13(9)17-12-4-1-10(15)2-5-12/h1-7H,8H2
- InChI Key： URZDCUITWRKUDE-UHFFFAOYSA-N
- SMILES： ClCC1C=C(C=CC=1SC1C=CC(=CC=1)Cl)F
Computed Properties
- Exact Mass: 285.97877
- Monoisotopic Mass: 285.9786050g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 232
- 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: 5.1
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- PSA: 0
Benzene, 2-(chloromethyl)-1-[(4-chlorophenyl)thio]-4-fluoro- Related Literature
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1. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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