Home Nitro Compounds 887407-16-1
887407-16-1,MFCD01632691
Catalog No.:AA004CPH

887407-16-1 | N-NITROSOANATABINE

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1mg
≥98%
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$173.00   $121.00
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5mg
≥98%
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$432.00   $302.00
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA004CPH
Chemical Name:
N-NITROSOANATABINE
CAS Number:
887407-16-1
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD01632691
SMILES:
O=NN1CC=CCC1c1cccnc1
Properties
Properties
 
BP:
367.8±42.0 °C(Predicted)  

Computed Properties
 
Complexity:
229  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.3  

Literature

Title: In vitro metabolism of N'-Nitrosonornicotine catalyzed by cytochrome P450 2A13 and its inhibition by nicotine, N'-Nitrosoanatabine and N'-Nitrosoanabasine.

Journal: Chemico-biological interactions 20161225

Title: Determination of tobacco-specific N-nitrosamines in urine of smokers and non-smokers.

Journal: Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals 20091201

Title: Analysis of tobacco-specific nitrosamines in Moldovan cigarette tobacco.

Journal: Journal of agricultural and food chemistry 20020508

Title: Smoke yields of tobacco-specific nitrosamines in relation to FTC tar level and cigarette manufacturer: analysis of the Massachusetts Benchmark Study.

Journal: Public health reports (Washington, D.C. : 1974) 20010101

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