Benzene, 2,4-dinitro-1-(methylthio)- (9CI)

CAS 2363-23-7 MFCD02363237

化学结构图

2363-23-7
SMILES: CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

化学属性

Mol. FormulaC7H6N2O4S
Mol. Weight214.21

别名和识别编码

Synonym Methyl 2,4-dinitrophenyl sulfide 1-Methylmercapto-2,4-dinitrobenzene Benzene, 2,4-dinitro-1-(methylthio)- 1-Methylsulfanyl-2,4-dinitro-benzene 2,4-Dinitrothioanisole 2,4-Dinitrophenyl methyl sulfide 2,4-Dinitro-1-(methylthio)benzene Benzene, 1-(methylthio)-2,4-dinitro-
InChIKeyCQLUVMHXDVLHSK-UHFFFAOYSA-N
Chemical NameBenzene, 2,4-dinitro-1-(methylthio)- (9CI)
CAS Number2363-23-7
Beilstein Registry Number2054390
PubChem Substance ID95251
InChIInChI=1S/C7H6N2O4S/c1-14-7-3-2-5(8(10)11)4-6(7)9(12)13/h2-4H,1H3
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分类

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

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.

安全信息

RTECSWQ5100000 
TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 100 umol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 176,171,1987

系列性分类

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