Bis(p-nitrophenyl) sulfoxide 氨苯砜杂质7

CAS 1774-38-5 MFCD00496608

化学结构图

1774-38-5
SMILES: O=[N+]([O-])c1ccc(S(=O)c2ccc([N+](=O)[O-])cc2)cc1

化学属性

Mol. FormulaC12H8N2O5S
Mol. Weight292.27

别名和识别编码

Chemical NameBis(p-nitrophenyl) sulfoxide
Synonym Dapsone Impurity 7 {LY} Dapsone Impurity 7 {} {LY} Dapsone Impurity 7 {} {} {LY} Dapsone Impurity 7 {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dapsone Impurity 7 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {}
CAS Number1774-38-5
Beilstein Registry Number1999385
InChIKeyFOPAYJWJHKMOHS-UHFFFAOYSA-N
PubChem Substance ID96633
InChIInChI=1S/C12H8N2O5S/c15-13(16)9-1-5-11(6-2-9)20(19)12-7-3-10(4-8-12)14(17)18/h1-8H
Chemical Name Translation 氨苯砜杂质7
Canonical SMILESO=N(=O)C1=CC=C(C=C1)S(=O)C2=CC=C(C=C2)N(=O)=O
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; sulfoxide; 1fragment

相关文献及参考

  • Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who intend to use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H, subvolume III/35D contains the nucleus 13C, subvolume III/35E contains the nucleus 17O, and subvolume III/35G contains the nucleus 77Se. More nuclei will be presented later.

安全信息

RTECSWS2295000
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NYKZAU Nippon Yakurigaku Zasshi.  Japanese Journal of Pharmacology. (Nippon
   Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho,
   Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40-    1944- Volume(issue)/page/year:
   48,336,1952

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NCNSA6 National Academy of Sciences, National Research Council,
   Chemical-Biological Coordination Center, Review.  (Washington, DC)
   Volume(issue)/page/year: 5,34,1953

Storage condition

系列性分类


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