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887407-16-1

887407-16-1 Structure

887407-16-1 Structure
IdentificationBack Directory
[Name]

N-NITROSOANATABINE
[CAS]

887407-16-1
[Synonyms]

(R,S)-NAT
N-NITROSOANATABINE
1,2,3,6-Tetrahydro-1-nitroso-2,3'-bipyridine
[Molecular Formula]

C10H11N3O
[MDL Number]

MFCD01632691
[MOL File]

887407-16-1.mol
[Molecular Weight]

189.21
Chemical PropertiesBack Directory
[Appearance]

Clear Yellow Oil
[Boiling point ]

367.8±42.0 °C(Predicted)
[density ]

1.22±0.1 g/cm3(Predicted)
[storage temp. ]

Refrigerator, Under Inert Atmosphere
[solubility ]

Chloroform: slightly soluble; Ethyl Acetate: slightly soluble
[form ]

neat
[pka]

5.06±0.12(Predicted)
[Stability:]

Light Sensitive
[InChI]

InChI=1S/C10H11N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h1-4,6,8,10H,5,7H2
[InChIKey]

ZJOFAFWTOKDIFH-UHFFFAOYSA-N
[SMILES]

C1(C2=CC=CN=C2)N(N=O)CC=CC1
Hazard InformationBack Directory
[Chemical Properties]

Clear Yellow Oil
[Uses]

(R,S)-N-Nitroso Anatabine is a metabolite of tobacco, a specific N-nitrosamines. (R,S)-N-Nitroso Anatabine
[Uses]

A metabolite of tobacco, a specific N-nitrosamines. Shows mutagenic effects
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

25
[Safety Statements ]

45
[RIDADR ]

UN2810 6.1/PG 3
[WGK Germany ]

3
[HS Code ]

29399990
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