Dibenzyl Phosphite - technical grade , CAS No.17176-77-1

CAS: 17176-77-1 Cat. No.: D131927 Summenformel: C₁₄H₁₅O₃P Molekulargewicht: 262.24 Beilstein Registry Number: 1982790 EG-Nummer: 241-226-1 PubChem CID: 6334615

GRADE & PURITY Technical grade

Synonyms

Dibenzyl phosphite | AS-57330 | MFCD00004774 | Bis(benzyloxy)(oxo)phosphanium | Dibenzylphosphit | EINECS 241-226-1 | 1O720L5H5A | Dibenzyl phosphite, technical grade | SCHEMBL36370 | DIBENZYL PHOSPHITE [MI] | DTXSID20938038 | oxo-bis(phenylmethoxy)phosph

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

Dibenzyl phosphite | AS-57330 | MFCD00004774 | Bis(benzyloxy)(oxo)phosphanium | Dibenzylphosphit | EINECS 241-226-1 | 1O720L5H5A | Dibenzyl phosphite, technical grade | SCHEMBL36370 | DIBENZYL PHOSPHITE [MI] | DTXSID20938038 | oxo-bis(phenylmethoxy)phosph

Spezifikationen & Reinheit

technical grade

Storage

Room temperature

Verschickt in

Normal

Note

Technische Qualität

Namen und Kennungen

• Kanonisches Lächeln: C1=CC=C(C=C1)CO[P+](=O)OCC2=CC=CC=C2
• IUPAC Name: oxo-bis(phenylmethoxy)phosphanium
• InChIKey: RQKYHDHLEMEVDR-UHFFFAOYSA-N
• INCHI: 1S/C14H14O3P/c15-18(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2/q+1
• Isomere SMILES: C1=CC=C(C=C1)CO[P+](=O)OCC2=CC=CC=C2
• WGK Deutschland: 3
• PubChem CID: 6334615
• Molekulargewicht: 262.24
• Beilstein: 1982790

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic cation - Aromatic homomonocyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Brechungsindex: 1.55
• Flammpunkt (°F): 230 °F
• Flammpunkt (°C): 110 °C
• Siedepunkt (°C): 165°C/0.1mmHg
• Molekulargewicht: 261.230 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 261.068 Da
• Monoisotopic Mass: 261.068 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 18
• Formal Charge: 1
• Complexity: 221.000
• 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