Cas no 68671-90-9 (2,3,5,6-Tetrachlorothioanisole)
68671-90-9 structure
Product Name:2,3,5,6-Tetrachlorothioanisole
2,3,5,6-Tetrachlorothioanisole Chemical and Physical Properties
Names and Identifiers
-
- 2,3,5,6-Tetrachlorothioanisole
- 1,2,4,5-tetrachloro-3-methylsulfanylbenzene
- 1-Methylthio-2,3,5,6-tetrachlorbenzol
- 2,3,4,5-TETRACB UNLABELED
- EINECS 272-054-5
- tecnazene metabolite
- Benzene, 1,2,4,5-tetrachloro-3-(methylthio)-
- AKOS024333943
- 68671-90-9
- 2,3,5,6-TETRACHLOROPHENYL METHYL SULFIDE
- 1,2,4,5-Tetrachloro-3-(methylsulfanyl)benzene #
- Benzene, 1,2,4,5-tetrachloro-3-methylthio-
- DTXSID30218813
- methyl(2,3,5,6-tetrachlorophenyl)sulfane
- 1,2,4,5-Tetrachloro-3-(methylsulfanyl)benzene
- methylthio-2,3,5,6-tetrachloro-benzene
- UNII-YNR6124E47
- NS00022688
- RHWCBXIUVHNKQC-UHFFFAOYSA-N
- 1,2,4,5-Tetrachloro-3-(methylthio)benzene
- METHYL 2,3,5,6-TETRACHLOROPHENYL SULFIDE
- YNR6124E47
- FT-0609410
- Q27294615
-
- Inchi： 1S/C7H4Cl4S/c1-12-7-5(10)3(8)2-4(9)6(7)11/h2H,1H3
- InChI Key： RHWCBXIUVHNKQC-UHFFFAOYSA-N
- SMILES： ClC1C(=CC(=C(C=1SC)Cl)Cl)Cl
Computed Properties
- Exact Mass: 259.87900
- Monoisotopic Mass: 259.878782g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 140
- 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: 25.30000
- LogP: 5.02210
2,3,5,6-Tetrachlorothioanisole Security Information
- Safety Instruction： S22-S24/25
- Safety Term：S22;S24/25
- Risk Phrases：R36/37/38
2,3,5,6-Tetrachlorothioanisole Related Literature
-
Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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