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117-18-0,MFCD00007066
Catalog No.:AA008RI3

117-18-0 | Tecnazene

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1g
98%(GC)
in stock  
$24.00   $17.00
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5g
95%
in stock  
$45.00   $32.00
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25g
95%
in stock  
$103.00   $73.00
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100g
95%
in stock  
$311.00   $218.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008RI3
Chemical Name:
Tecnazene
CAS Number:
117-18-0
Molecular Formula:
C6HCl4NO2
Molecular Weight:
260.8896
MDL Number:
MFCD00007066
SMILES:
Clc1cc(Cl)c(c(c1Cl)[N+](=O)[O-])Cl
NSC Number:
10235
Properties
Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
3.9  

Downstream Synthesis Route

[1]Dyson;George;Hunter[JournaloftheChemicalSociety,1926,p.3044]

[2]Holleman[RecueildesTravauxChimiquesdesPays-Bas,1920,vol.39,p.748][RecueildesTravauxChimiquesdesPays-Bas,1921,vol.40,p.318]

[3]Peters;Rowe;Stead[JournaloftheChemicalSociety,1943,p.576]

[4]Sott,Richard;Hawner,Christine;Johansen,JonE.[Tetrahedron,2008,vol.64,#18,p.4135-4142]

[1]Fryszkowska,Anna;Tilford,RobertW.;Guo,Fengli;Kaszynski,Piotr[Tetrahedron,2005,vol.61,#9,p.2327-2333]

[2]Holleman[RecueildesTravauxChimiquesdesPays-Bas,1920,vol.39,p.748][RecueildesTravauxChimiquesdesPays-Bas,1921,vol.40,p.318]

[3]Holleman[RecueildesTravauxChimiquesdesPays-Bas,1920,vol.39,p.748][RecueildesTravauxChimiquesdesPays-Bas,1921,vol.40,p.318]

Literature

Title: Molecular structure, vibrational spectra, HOMO, LUMO and NMR studies of 1,2-dichloro-4-nitrobenzene and 2,3,5,6-tetrachloro-1-nitrobenzene based on density functional calculations.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120201

Title: Permeation of tecnazene through human skin in vitro as assessed by HS-SPME and GC-MS.

Journal: Environmental science & technology 20080901

Title: Residues of 18 organochlorine pesticides in 30 traditional Chinese medicines.

Journal: Chemosphere 20080401

Title: Increased scratching counts depend on a decrease in ability of cutaneous prostaglandin D2 biosynthesis in NC/Nga mice with atopic dermatitis.

Journal: Experimental dermatology 20051201

Title: Scratching behavior in spontaneous- or allergic contact-induced dermatitis in NC/Nga mice.

Journal: Experimental dermatology 20051101

Title: Studies on TMPD:TCNB; a donor-acceptor with room temperature paramagnetism and n-pi interaction.

Journal: Molecules (Basel, Switzerland) 20040831

Title: Ion chromatographic determination of the decomposition products of tecnazene solution irradiated by ultraviolet light: inorganic and organic anions.

Journal: Journal of agricultural and food chemistry 20010601

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SDS
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