Nitrosobis(2-hydroxyethyl)amine-d8 - ≥99 atom% D,≥98% , CAS No.1173019-53-8

CAS: 1173019-53-8 Cat. No.: N345148 Fórmula: C₄H₂D₈N₂O₃ Peso molecular: 142.18 Número CE: 694-221-5

GRADE & PURITY ≥99 atom% D,≥98%

Synonyms

N,N-Bis[2-hydroxy(~2~H_4_)ethyl]nitrous amide | N-Nitrosobis(2-hydroxyethyl)-d8-amine | YWB01953 | N-Nitrosodiethan-d8-olamine, >=98 atom % D, >=98% (CP) | 2,2'-(Nitrosoimino)bisethanol-d8; Diethanolnitrosamine-d8; N,N-Diethanolnitrosamine-d8; N-Nitrosodi

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Visão geral

Nitrosobis(2-hydroxyethyl)amine-d8 is a deuterated chemical of a potent liver carcinogen in several species of animals, is one of the most widespread N-nitroso compounds in the human environment.

Specifications

Sinónimos

N,N-Bis[2-hydroxy(~2~H_4_)ethyl]nitrous amide | N-Nitrosobis(2-hydroxyethyl)-d8-amine | YWB01953 | N-Nitrosodiethan-d8-olamine, >=98 atom % D, >=98% (CP) | 2,2'-(Nitrosoimino)bisethanol-d8; Diethanolnitrosamine-d8; N,N-Diethanolnitrosamine-d8; N-Nitrosodi

Especificações e pureza

≥99 atom% D,≥98%

Condições de armazenamento de armazenamento

Protected from light,Store at -20°C,Argon charged

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥99 atom% D,≥98%

Nomes e identificadores

• Sorrisos canónicos: C(CO)N(CCO)N=O
• IUPAC Name: N,N-bis(1,1,2,2-tetradeuterio-2-hydroxyethyl)nitrous amide
• InChIKey: YFCDLVPYFMHRQZ-SVYQBANQSA-N
• INCHI: 1S/C4H10N2O3/c7-3-1-6(5-9)2-4-8/h7-8H,1-4H2/i1D2,2D2,3D2,4D2
• SMILES isoméricas: [2H]C([2H])(C([2H])([2H])O)N(C([2H])([2H])C([2H])([2H])O)N=O
• Peso molecular: 142.18
• Reaxy-Rn: 1762620
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1762620&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Organic nitroso compounds

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Organic nitroso compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic N-nitroso compounds
• Alternative Parents: Alkanolamines Primary alcohols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic n-nitroso compound - Alkanolamine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as organic n-nitroso compounds. These are organic compounds containing a n-nitroso group -NN=O.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Solubilidade: DMSO (Slightly), Methanol (Slightly), Water (Slightly)
• Sensibilidade: Light sensitive;Moisture sensitive
• Peso molecular: 142.180 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 142.119 Da
• Monoisotopic Mass: 142.119 Da
• Topological Polar Surface Area: 73.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 72.200
• Isotope Atom Count: 8
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

What is the purity of this product?

This product is isotopically enriched to ≥99 atom% deuterium. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1173019-53-8, the molecular formula is C4H2D8N2O3, and the molecular weight is 142.18 g/mol. InChIKey YFCDLVPYFMHRQZ-SVYQBANQSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.