N-Nitrosuccinimide - ≥98% , CAS No.5336-95-8

CAS: 5336-95-8 Cat. No.: N404115 Fórmula: C₄H₄N₂O₄ Peso molecular: 144.09 Número CE: 878-810-6

GRAU & PUREZA ≥98%

Synonyms

NSC393 | NSC-393 | UNII-RG5CGV762E | SCHEMBL2493890 | 2,5-Pyrrolidinedione, 1-nitro- | Succinimide, N-nitro- | 1-nitro-pyrrolidine-2,5-dione | 1-nitropyrrolidine-2,5-dione | 1-nitro-2,5-pyrrolidinedione | 1-Nitro-2,5-pyrrolidine-dione | DTXSID50201525 | R

Storage

Room temperature

Especificações

Sinónimos

NSC393 | NSC-393 | UNII-RG5CGV762E | SCHEMBL2493890 | 2,5-Pyrrolidinedione, 1-nitro- | Succinimide, N-nitro- | 1-nitro-pyrrolidine-2,5-dione | 1-nitropyrrolidine-2,5-dione | 1-nitro-2,5-pyrrolidinedione | 1-Nitro-2,5-pyrrolidine-dione | DTXSID50201525 | R

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504757161

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757161

Sorrisos canónicos

C1CC(=O)N(C1=O)[N+](=O)[O-]

IUPAC Name

1-nitropyrrolidine-2,5-dione

InChIKey

LVBLRJFVMMAALZ-UHFFFAOYSA-N

INCHI

1S/C4H4N2O4/c7-3-1-2-4(8)5(3)6(9)10/h1-2H2

SMILES isoméricas

C1CC(=O)N(C1=O)[N+](=O)[O-]

Peso molecular

144.09

Reaxy-Rn

141021

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=141021&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrrolidines
      • Subclass Pyrrolidones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolidines
• Subclass: Pyrrolidones
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolidine-2-ones
• Alternative Parents: Dicarboximides Organic nitro compounds Lactams Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 2-pyrrolidone - Dicarboximide - Lactam - Organic nitro compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as pyrrolidine-2-ones. These are pyrrolidines which bear a C=O group at position 2 of the pyrrolidine ring.
• 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

• Ponto de fusão (°C): 96 °C
• Peso molecular: 144.090 g/mol
• XLogP3: -0.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 144.017 Da
• Monoisotopic Mass: 144.017 Da
• Topological Polar Surface Area: 83.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 190.000
• 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

Perguntas frequentes

What is the purity of this product?

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 room temperature.

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

The CAS Number is 5336-95-8, the molecular formula is C4H4N2O4, and the molecular weight is 144.09 g/mol. InChIKey LVBLRJFVMMAALZ-UHFFFAOYSA-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.