Diphenylphosphinamide - ≥97% , CAS No.5994-87-6

CAS: 5994-87-6 Cat. No.: D332002 Fórmula: C₁₂H₁₂NOP Peso molecular: 217.2 Número EC: 626-207-1

GRADE & PURITY ≥97%

Synonyms

DTXSID40357449 | SY109328 | D70328 | RIGIWEGXTTUCIQ-UHFFFAOYSA-N | P,P-diphenylphosphinic amide | A832549 | Diphenyl phosphinic acid amide | C12H12NOP | Diphenylphosphinamide, 97% | Diphenylphosphinamide | MFCD00014766 | FT-0635934 | AC-31067 | [amino(phe

Storage

Room temperature,Argon charged

Shipped In

Normal

Descripción general

application：

Diphenylphosphinamide is used to furnish 5H-oxazol-4-ones with diastereoselectivity and enantioselectivity.   

Specifications

Sinónimos

DTXSID40357449 | SY109328 | D70328 | RIGIWEGXTTUCIQ-UHFFFAOYSA-N | P,P-diphenylphosphinic amide | A832549 | Diphenyl phosphinic acid amide | C12H12NOP | Diphenylphosphinamide, 97% | Diphenylphosphinamide | MFCD00014766 | FT-0635934 | AC-31067 | [amino(phe

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488191636
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488191636
• Sonrisas canónicas: C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)N
• IUPAC Name: [amino(phenyl)phosphoryl]benzene
• InChIKey: RIGIWEGXTTUCIQ-UHFFFAOYSA-N
• INCHI: 1S/C12H12NOP/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,13,14)
• Isómeros SMILES: C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)N
• WGK Alemania: 3
• Peso molecular: 217.2
• Reaxy-Rn: 1954146
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1954146&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Organopnictogen compounds Organophosphorus compounds Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organophosphorus compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

• Solubilidad: Soluble in chloroform, nitromethane, nitrobenzene.
• Punto de fusión (°C): 162-166° C
• Peso molecular: 217.200 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 217.066 Da
• Monoisotopic Mass: 217.066 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 220.000
• 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

Referencias

1. Haotian Gu, Tenglong Sun, Yining Feng, Muzhi Cai, Jintian Tang, Shiqing Xu.  (2025)  Impact of phospho-oxygen derivatives on crystallinity and optoelectronic properties of CsSnBr3 LED.  OPTICAL MATERIALS,      [PMID:] [10.1016/j.optmat.2025.116781]