2-(Triphenylphosphoranylidene)succinic anhydride - ≥97% , CAS No.906-65-0

CAS: 906-65-0 Cat. No.: T332722 Peso molecular: 360.34 Número EC: 212-998-7 PubChem CID: 70183

GRADE & PURITY ≥97%

Synonyms

2-(Triphenylphosphoranylidene)succinic anhydride | 2-(triphenyl-phosphoranylidene)succinic anhydride | 2-(Triphenylphosphoranylidene)succinic anhydride, 97% | Lerociclib (USAN) | UNII-85UZS3DN56 | AS-67965 | 3-(triphenyl-lambda5-phosphanylidene)oxolane-2,

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

2-(Triphenylphosphoranylidene)succinic anhydride | 2-(triphenyl-phosphoranylidene)succinic anhydride | 2-(Triphenylphosphoranylidene)succinic anhydride, 97% | Lerociclib (USAN) | UNII-85UZS3DN56 | AS-67965 | 3-(triphenyl-lambda5-phosphanylidene)oxolane-2,

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488184496
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184496
• Sonrisas canónicas: C1C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC1=O
• IUPAC Name: 3-(triphenyl-λ5-phosphanylidene)oxolane-2,5-dione
• InChIKey: CXYNGWAHZKOMJQ-UHFFFAOYSA-N
• INCHI: 1S/C22H17O3P/c23-21-16-20(22(24)25-21)26(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16H2
• Isómeros SMILES: C1C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC1=O
• WGK Alemania: 3
• PubChem CID: 70183
• Peso molecular: 360.34

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylphosphines and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylphosphines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylphosphines and derivatives
• Alternative Parents: Dicarboxylic acids and derivatives Tetrahydrofurans Carboxylic acid anhydrides Lactones Oxacyclic compounds Organopnictogen compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Triphenylphosphine - Phenylphosphine - Dicarboxylic acid or derivatives - Tetrahydrofuran - Carboxylic acid anhydride - Lactone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organophosphorus compound - Organooxygen compound - Carbonyl group - Organic oxide - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylphosphines and derivatives. These are compounds containing a phenylphosphine, which consists of phosphine substituent bound to a phenyl group.
• 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

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 167° C (lit.)(dec.)
• Peso molecular: 360.300 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 360.092 Da
• Monoisotopic Mass: 360.092 Da
• Topological Polar Surface Area: 43.400 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 538.000
• 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