Dibenzyl Phosphate - ≥99% , CAS No.1623-08-1

CAS: 1623-08-1 Cat. No.: D131779 Summenformel: C₁₄H₁₅O₄P Molekulargewicht: 278.24 Beilstein Registry Number: 6439 EG-Nummer: 216-602-3

GRADE & PURITY ≥99%

Synonyms

SCHEMBL51316 | Dibenzyl hydrogen phosphate | MFCD00137817 | SMR001227194 | DTXCID9013402 | Phosphoric acid, dibenzyl ester | Tox21_201050 | UNII-Y65R35LZ0S | MFCD00004775 | C14H15O4P | Phosphoric acid, bis(phenylmethyl) ester | CAS-1623-08-1 | Dibenzyl hy

Storage

Store at 2-8°C

Shipped In

Wet ice

Übersicht

Dibenzyl phosphate (DBzP) can be used:

· To promote the monoselective ortho-C-H alkylation of N-quinolyl benzamides with primary and secondary alkyl iodides.

· For the ring-opening reaction of epoxide such as benzylglycidol to synthesize dihydroxyacetone phosphate (DHAP).

· As a reactant for the synthesis of stereospecific 1,2-trans glycosyl phosphates.

Specifications

Synonyme

SCHEMBL51316 | Dibenzyl hydrogen phosphate | MFCD00137817 | SMR001227194 | DTXCID9013402 | Phosphoric acid, dibenzyl ester | Tox21_201050 | UNII-Y65R35LZ0S | MFCD00004775 | C14H15O4P | Phosphoric acid, bis(phenylmethyl) ester | CAS-1623-08-1 | Dibenzyl hy

Spezifikationen & Reinheit

≥99%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 488184880
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184880
• Kanonisches Lächeln: C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2
• IUPAC Name: dibenzyl hydrogen phosphate
• InChIKey: HDFFVHSMHLDSLO-UHFFFAOYSA-N
• INCHI: 1S/C14H15O4P/c15-19(16,17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,15,16)
• Isomere SMILES: C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2
• WGK Deutschland: 3
• Molekulargewicht: 278.24
• Beilstein: 6439
• Reaxy-Rn: 2055755
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2055755&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Organic phosphoric acids and derivatives
      • Subclass Phosphate esters
        • Ebene5 Alkyl phosphates
          • Ebene6 Dialkyl phosphates

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Organic phosphoric acids and derivatives
• Subclass: Phosphate esters
• Intermediate Tree Nodes: Alkyl phosphates
• Direct Parent: Dialkyl phosphates
• Alternative Parents: Benzene and substituted derivatives Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Dialkyl phosphate - Benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dialkyl phosphates. These are organic compounds containing a phosphate group that is linked to exactly two alkyl chain.
• 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

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (partly), chloroform, dichloromethane, ethyl acetate, and methanol.
• Empfindlichkeit: Heat sensitive
• Schmelzpunkt (°C): 78-80 °C
• Molekulargewicht: 278.240 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 278.071 Da
• Monoisotopic Mass: 278.071 Da
• Topological Polar Surface Area: 55.800 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 270.000
• 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

Referenzen

1. Zhilong Xu, Kai Yu, Siyu Zhu, Yun Ju, Jing Zhao, Hong Zhang, Mingyi Wang, Jie Jiang, Jing He.  (2026)  Organophosphate diesters interfere with hypochlorous acid-induced phospholipid reactions at the air-water interface.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:41564757] [10.1016/j.jhazmat.2026.141203]