N-Nitrosodimethylamine - ≥99% , CAS No.62-75-9

CAS: 62-75-9 Cat. No.: N396014 Formule: C₂H₆N₂O Poids moléculaire: 74.08 Numéro CE: 200-549-8

QUALITÉ & PURETÉ ≥99%

Synonyms

N-NITROSODIMETHYLAMINE|Dimethylnitrosamine|62-75-9|NDMA|N-Methyl-N-nitrosomethanamine|Dimethylnitrosoamine|N,N-Dimethylnitrosamine|DMNA|Nitrosodimethylamine|N,N-dimethylnitrous amide|Methanamine, N-methyl-N-nitroso-|Dimethylnitrosamin|N-Nitroso-N,N-dimeth

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Spécifications

Synonymes

N-NITROSODIMETHYLAMINE | Dimethylnitrosamine | 62-75-9 | NDMA | N-Methyl-N-nitrosomethanamine | Dimethylnitrosoamine | N,N-Dimethylnitrosamine | DMNA | Nitrosodimethylamine | N,N-dimethylnitrous amide | Methanamine, N-methyl-N-nitroso- | Dimethylnitrosamin | N-Nitroso-N,N-dimeth

Spécifications et pureté

≥99%

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

FedEx DG Service

Pureté

≥99%

Noms et identifiants

Pubchem Sid

488180010

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180010

Sourires canoniques

CN(C)N=O

IUPAC Name

N,N-dimethylnitrous amide

InChIKey

UMFJAHHVKNCGLG-UHFFFAOYSA-N

INCHI

1S/C2H6N2O/c1-4(2)3-5/h1-2H3

Isomères SMILES

CN(C)N=O

WGK Allemagne

3

RTECS

IQ0525000

Numéro ONU

2810

Groupe d'emballage

I

Poids moléculaire

74.08

Reaxy-Rn

1738979

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1738979&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: Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic n-nitroso compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: 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: nitrosamine

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

Cibles associées (humaines)

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Lymphoblastoid cell (5959 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Cibles associées (non humaines)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Rattus norvegicus (775804 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)

Discover Target: Txnrd1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Soluble in water, alcohol and ether
• Sensibilité: Air sensitive
• Indice de réfraction: 1.44
• Point d'éclair (°C): 61 °C
• Point d'ébullition (°C): 153°C
• Poids moléculaire: 74.080 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 74.048 Da
• Monoisotopic Mass: 74.048 Da
• Topological Polar Surface Area: 32.700 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 34.600
• Isotope Atom Count: 0
• 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