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1,4-Dinitrosopiperazine

CAT: 0572-TRC-D480420-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D480420-500MGSize:500 mg
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CAS Number
140-79-4
Synonyms
Piperazine, 1,4-dinitroso-; DNP; N,N'-Dinitrosopiperazine; NSC 339
Hazard Statement
Toxic if swallowed; UN number: UN2811; Packing Group: III
Purity
>95% (GC)
Smiles
O=NN1CCN(CC1)N=O
Molecular Formula
C4 H8 N4 O2
Molecular Weight
144.13
InChI
InChI=1S/C4H8N4O2/c9-5-7-1-2-8(6-10)4-3-7/h1-4H2
Additionnal Information
IUPAC name: 1,4-dinitrosopiperazine
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

N,N'-Dinitrosopiperazine

Carcinogen is any chemical, biological or physical agents that increase the risk of neoplasms in humans or animals. Carcinogens include natural or synthesized compounds, certain viruses, and various sources of radiation. A carcinogen may directly alter the genetic material of cells (genotoxic), thereby initiating or promoting the process of malignant transformation; it also may induce cancers by mechanisms that do not involve a direct alteration of cellular genetic material (non-genotoxic). (NCI04)

CAS Number140-79-4
PubChem CID8819
IUPAC Name1,4-dinitrosopiperazine
Molecular FormulaC4H8N4O2
Molecular Weight144.13
XLogP-0.8
Topological Polar Surface Area65.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity115
SMILES
C1CN(CCN1N=O)N=O
InChI
InChI=1S/C4H8N4O2/c9-5-7-1-2-8(6-10)4-3-7/h1-4H2
InChIKey
WNSYEWGYAFFSSQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N,N'-Dinitrosopiperazine
CAS: 140-79-4
CID: 8819
Formula: C4H8N4O2
MW: 144.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight144.13
XLogP3-0.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass144.06472551
Monoisotopic Mass144.06472551
Topological Polar Surface Area65.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity115
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes