N-Phenylsuccinimide - ≥98%(GC) , CAS No.83-25-0

CAS: 83-25-0 Cat. No.: N159129 Formule: C₁₀H₉NO₂ Poids moléculaire: 175.19 Beilstein Registry Number: 21(3/4)4547 Numéro CE: 678-416-2

GRADE & PURITY ≥98%(GC)

Synonyms

37Y8E9UODY | HMS2842N17 | InChI=1/C10H9NO2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h1-5H,6-7H | N-Phenylmaleimide (reacted form of) | SCHEMBL370611 | D70370 | N-Phenylsuccinimide | NCGC00245040-01 | 1-Phenyl-2,5-pyrrolidinedione # | FT-0631380 | HMS1671J07 | a

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonymes

37Y8E9UODY | HMS2842N17 | InChI=1/C10H9NO2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h1-5H,6-7H | N-Phenylmaleimide (reacted form of) | SCHEMBL370611 | D70370 | N-Phenylsuccinimide | NCGC00245040-01 | 1-Phenyl-2,5-pyrrolidinedione # | FT-0631380 | HMS1671J07 | a

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

504754076

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754076

Sourires canoniques

C1CC(=O)N(C1=O)C2=CC=CC=C2

IUPAC Name

1-phenylpyrrolidine-2,5-dione

InChIKey

ZTUKZULGOCFJET-UHFFFAOYSA-N

INCHI

1S/C10H9NO2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h1-5H,6-7H2

Isomères SMILES

C1CC(=O)N(C1=O)C2=CC=CC=C2

Poids moléculaire

175.19

Beilstein

21(3/4)4547

Reaxy-Rn

140672

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=140672&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolidines
• Subclass: Phenylpyrrolidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpyrrolidines
• Alternative Parents: Pyrrolidine-2-ones N-substituted carboxylic acid imides Benzene and substituted derivatives Pyrroles Dicarboximides Lactams Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 1-phenylpyrrolidine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Benzenoid - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Carboxylic acid derivative - Azacycle - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
• External Descriptors: a small molecule

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

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Mécanismes d'action

Propriétés chimiques et physiques

• Sensibilité: Heat Sensitive
• Point de fusion (°C): 155 °C
• Poids moléculaire: 175.180 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 175.063 Da
• Monoisotopic Mass: 175.063 Da
• Topological Polar Surface Area: 37.400 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 215.000
• 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

Foire aux questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. 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 83-25-0, the molecular formula is C10H9NO2, and the molecular weight is 175.19 g/mol. InChIKey ZTUKZULGOCFJET-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.