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N'-NITROSONORNICOTINE

Product Name
N'-NITROSONORNICOTINE
CAS No.
16543-55-8
Chemical Name
N'-NITROSONORNICOTINE
Synonyms
NNN;(2S)-N’nitrosonornicotine;N-NITROSONORNICOTINE;1’-nitrosonornicotine;N'-NITROSONORNICOTINE;N'-NITROSONORNICOTINE;-Nitrosonornicotine-d4;N-nitroso nicotine (NNN);(S)-N’-Nitrosonornicotine
CBNumber
CB6227878
Molecular Formula
C9H11N3O
Formula Weight
177.2
MOL File
16543-55-8.mol
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N'-NITROSONORNICOTINE Property

Melting point:
47.1°C
Boiling point:
309.13°C (rough estimate)
Density 
1.1669 (rough estimate)
refractive index 
1.6500 (estimate)
storage temp. 
Hygroscopic, Refrigerator, Under Inert Atmosphere
solubility 
Chloroform (Slightly), Methanol (Slightly)
form 
Solid
pka
5.16±0.12(Predicted)
color 
Off-White to Pale Beige
Stability:
Stable, but air and light sensitive. Incompatible with oxidizing agents.
IARC
1 (Vol. Sup 7, 89, 100E) 2012
EPA Substance Registry System
N-Nitrosonornicotine (16543-55-8)
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Safety

Hazard Codes 
Xn
Risk Statements 
36/37/38-40
Safety Statements 
26-36
RIDADR 
2810
HazardClass 
6.1(b)
PackingGroup 
III
Hazardous Substances Data
16543-55-8(Hazardous Substances Data)
Toxicity
LD50 intraperitoneal in mouse: 1gm/kg
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H301Toxic if swalloed

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P301+P310IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

P321Specific treatment (see … on this label).

P330Rinse mouth.

P405Store locked up.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
N-075
Product name
(±)-N′-Nitrosonornicotine (NNN) solution
Purity
1.0?mg/mLinmethanol,ampuleof1?mL,certifiedreferencematerial,Cerilliant?
Packaging
1mL
Price
$131
Updated
2022/05/15
TRC
Product number
N535001
Product name
(2S)-N’-Nitrosonornicotine
Packaging
10mg
Price
$185
Updated
2021/12/16
Medical Isotopes, Inc.
Product number
D34102
Product name
N?-Nitrosonornicotine-d4
Packaging
5mg
Price
$1250
Updated
2021/12/16
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N'-NITROSONORNICOTINE Chemical Properties,Usage,Production

Description

A nicotine alkaloid, this base has been detected in some Japanese cigarette tobaccos and also in Kirsu tobacco where it occurs in the fresh leaves that have been dried without fermentation. From these two sources it has been isolated at 1.1 and 1. 8 ppm levels respectively

Chemical Properties

white crystals

Uses

A tobacco alkaloid as risk factor of human cancer.

General Description

White crystalline flakes or yellow oil that solidifies on standing in the cold.

Air & Water Reactions

Insoluble in water.

Reactivity Profile

A nitrated amine, nicotine derivative. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.

Health Hazard

ACUTE/CHRONIC HAZARDS: When heated to decomposition it may emit toxic and hazardous fumes of NOx and COx.

Fire Hazard

Flash point data for N'-NITROSONORNICOTINE are not available; however, N'-NITROSONORNICOTINE is probably combustible.

Safety Profile

Confirmed carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Low toxicity by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS.

Carcinogenicity

N-Nitrosonornicotine is reasonably anticipated to be a human carcinogen based on sufficient evidence of carcinogenicity from studies in experimental animals.

References

Bharadwaj et al., Gann., 66, 585 (1975)

N'-NITROSONORNICOTINE Preparation Products And Raw materials

Raw materials

Preparation Products

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N'-NITROSONORNICOTINE Suppliers

Canada 2 China 31 Europe 1 Germany 1 India 2 Norway 1 South Korea 1 United Kingdom 2 United States 6 Global 47

16543-55-8, N'-NITROSONORNICOTINERelated Search:

DL-N'-NITROSONORNICOTINE-2,4,5,6-D4 (PYRIDINE-D4) N'-NITROSONORNICOTINE-2,4,5,6-D4(PYRIDINE-D4) 98%ATOM D,N'-NITROSONORNICOTINE-2,4,5,6-D4(PYRIDINE-D4) 98%ATOM D N-NITROSOPYRROLIDINE N'-NITROSONORNICOTINE N'-Nitrosonornicotine-N-b-D-glucuronide,N'-Nitrosonornicotine-N-b-D-glucuronide rac N'-Nitrosonornicotine,rac N'-Nitrosonornicotine rac-N'-Nitrosonornicotine 1-N-Oxide,rac-N'-Nitrosonornicotine 1-N-Oxide N'-Nitrosonornicotine N-D-Glucoside, Acetate Salt (Mixture Of Diastereomers),N'-Nitrosonornicotine N-D-Glucoside, Acetate Salt (Mixture Of Diastereomers) N'-Nitrosonornicotine N-b-D-Glucuronide (Mixture Of Diastereomers) X Hydrate N’-Nitrosonornicotine-5-carboxylic Acid,N’-Nitrosonornicotine-5-carboxylic Acid (R)-N-NITROSONORNICOTINE, [PYRIDYL-5-3H]-, HPLC PURIFIED, 97% PURE WITH HPLC RADIOCHROMATOGRAM (S)-N-NITROSONORNICOTINE, [PYRIDYL-5-3H]-, HPLC PURIFIED, 97% PURE WITH HPLC RADIOCHROMATOGRAM N'-NITROSONORNICOTINE,N'-NITROSONORNICOTINE (R)-N-NITROSONORNICOTINE, [PYRIDYL-5-3H]-,(R)-N-NITROSONORNICOTINE, [PYRIDYL-5-3H]- 5'-CARBOXY-N'-NITROSONORNICOTINE,5'-CARBOXY-N'-NITROSONORNICOTINE [5-3H]Nitrosonornicotine,[5-3H]Nitrosonornicotine N'-nitrosonornicotine-N-oxide,N'-nitrosonornicotine-N-oxide RAC N'-NITROSONORNICOTINE-D4,RAC N'-NITROSONORNICOTINE-D4

  • 1’-demethyl-1’-nitroso-nicotin
  • 1’-desmethyl-1’-nitrosonicotine
  • 1’-nitroso-1’-demethyl-nicotin
  • 1’-nitroso-1’-demethylnicotine
  • 1’-nitrosonornicotine
  • 1-nitroso-2-(3-pyridyl)pyrrolidine
  • nitrosonornicotine
  • -Nitrosonornicotine-d4
  • (2S)-N&rsquo
  • (S)-3-(1-Nitrosopyrrolidin-2-yl)pyridine
  • NNN
  • N'-NITROSONORNICOTINE
  • N-NITROSONORNICOTINE
  • (2S)-N'-Nitrosonornicotine
  • (S)-3-(1-Nitroso-2-pyrrolidinyl)pyridine
  • Pyridine, 3-[(2S)-1-nitroso-2-pyrrolidinyl]-
  • N-nitroso nicotine (NNN)
  • (S)-N’-Nitrosonornicotine
  • N'-NITROSONORNICOTINE
  • (2S)-N'-Nitrosonornicotine
  • 16543-55-8
  • 808508-23-2
  • Aromatics
  • Chiral Reagents
  • Heterocycles
  • Nicotine Derivatives