Products for Research Use Only
RegisterLogin

N-Nitrosoanatabine

CAT: 0804-HY-145476Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-145476Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
(R, S) -N-Nitrosoanatabine (N-NAT) is a tobacco-specific nitrosamine (TSNA) that has been found in tobacco, tobacco products, and electronic cigarettes. The (S) enantiomer comprises approximately 80% of the N-NAT found in commercial and research cigarettes and smokeless tobacco.3 Unlike other TSNAs, N-NAT is not carcinogenic in rats when administered at doses of 1, 3, and 9 mmol/kg.
CAS Number
887407-16-1
Product Name Alternative
N-NAT; N'-Nitrosoanatabine
UNSPSC
12352005
Hazard Statement
H301
Target
Biochemical Assay Reagents
Type
Reference compound
Related Pathways
Others
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/n-nitrosoanatabine.html
Purity
99.70
Smiles
O=NN1CC=CCC1C2=CC=CN=C2
Molecular Formula
C10H11N3O
Molecular Weight
189.21
Precautions
H301
References & Citations
[1]Hoffmann, et al. Dose-response study of the carcinogenicity of tobacco-specific N-nitrosamines in F344 rats. J. Cancer Res. Clin. Oncol. 108 (1), 81-86 (1984) .
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

1,2,3,6-Tetrahydro-1-nitroso-2,3'-bipyridine
CAS Number887407-16-1
PubChem CID528366
IUPAC Name3-(1-nitroso-3,6-dihydro-2H-pyridin-2-yl)pyridine
Molecular FormulaC10H11N3O
Molecular Weight189.21
XLogP1.3
Topological Polar Surface Area45.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity229
SMILES
C1C=CCN(C1C2=CN=CC=C2)N=O
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
Chemical Structure
2D Structure
2D structure of 1,2,3,6-Tetrahydro-1-nitroso-2,3'-bipyridine
CAS: 887407-16-1
CID: 528366
Formula: C10H11N3O
MW: 189.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight189.21
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass189.090211983
Monoisotopic Mass189.090211983
Topological Polar Surface Area45.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity229
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-135072-01N, N', N''-Triacetylchitotriose
HY-W011556-01N, N, N', N'-Tetramethylchloroformamidinium hexafluorophosphate
HY-W021358-01N, N, N′, N′-Tetramethyl-p-phenylenediamine
HY-139728-01N, N, N′, N′-Tetracyclohexyl-3-oxapentanediamide
HY-N7404-01Nε, Nε, Nε-Trimethyllysine (chloride)
HY-135072RN, N', N''-Triacetylchitotriose (Standard)
HY-W016923-01N, N, N-Trimethylbenzenaminium (chloride)
HY-W576312N, N-Dimethyltryptamine N-oxide
HY-W101257N, N, N-Trimethylethanaminium (iodide)
HY-W127842-01N, N-Dimethyldecylamine N-oxide

Alternative Products

CatalogName
GTR19265893-01N-Nitrosoanatabine
GTR19274948-01(S) -N-Nitrosoanatabine
S-2734N-Nitrosoanatabine - 1ML
sc-212643(R, S) -N-Nitrosoanatabine
AR-N01450-01(R, S) -N-Nitrosoanatabine-d4
N2645-04B(R, S) -N-Nitrosoanatabine (NAT)
AR-N01451-01(R, S) -N-Nitrosoanatabine-d10
MBS6061447-01(R,S)-N-Nitrosoanatabine (NAT)
sc-219711(R, S) -N-Nitrosoanatabine N-β-D-Glucuronide (Mixture of Diastereomers)
sc-219712A(R, S) -N-Nitrosoanatabine-2,4,5,6-d4

Popular Products