(2-hydroxybenzyl)diphenylphosphine oxide - ≥98% , CAS No.70127-50-3

CAS: 70127-50-3 Cat. No.: H304440 Peso molecular: 308.31 Número EC: 845-556-2

GRADE & PURITY ≥98%

Synonyms

Phenol, 2-[(diphenylphosphinyl)methyl]- | AT10037 | SY263919 | H1763 | 2-(diphenylphosphorylmethyl)phenol | NS-00168 | MLS000595037 | EN300-7463137 | 2-(Diphenylphosphinylmethyl)phenol | HMS2545N07 | SCHEMBL10824828 | SMR000184423 | 2-[(diphenylphosphoryl

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

Phenol, 2-[(diphenylphosphinyl)methyl]- | AT10037 | SY263919 | H1763 | 2-(diphenylphosphorylmethyl)phenol | NS-00168 | MLS000595037 | EN300-7463137 | 2-(Diphenylphosphinylmethyl)phenol | HMS2545N07 | SCHEMBL10824828 | SMR000184423 | 2-[(diphenylphosphoryl

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488191489
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488191489
• Sonrisas canónicas: C1=CC=C(C=C1)P(=O)(CC2=CC=CC=C2O)C3=CC=CC=C3
• IUPAC Name: 2-(diphenylphosphorylmethyl)phenol
• InChIKey: NQWHOPCJTGVYOX-UHFFFAOYSA-N
• INCHI: 1S/C19H17O2P/c20-19-14-8-7-9-16(19)15-22(21,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14,20H,15H2
• Isómeros SMILES: C1=CC=C(C=C1)P(=O)(CC2=CC=CC=C2O)C3=CC=CC=C3
• Peso molecular: 308.31
• Reaxy-Rn: 2944569
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2944569&ln=

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: 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organopnictogen compounds Organophosphorus compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenylphosphine - Phenol - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Aromatic homomonocyclic 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Light Sensitive,Air Sensitive
• Punto de ebullición (°C): 465.1±28.0℃at 760 mmHg
• Punto de fusión (°C): 178 °C
• Peso molecular: 308.300 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 308.097 Da
• Monoisotopic Mass: 308.097 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 361.000
• 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