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

CAS: 1623-08-1 Cat. No.: D131779 Peso molecular: 278.24 Beilstein Registry Number: 6439 Número EC: 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

Descripción general

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

Sinónimos

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

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 488184880
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184880
• Sonrisas canónicas: 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)
• Isómeros SMILES: C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2
• WGK Alemania: 3
• Peso molecular: 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
    • Clase Organic phosphoric acids and derivatives
      • Subclass Phosphate esters
        • Level5 Alkyl phosphates
          • Level6 Dialkyl phosphates

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: 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
• Descripción: 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

Objetivos asociados (humanos)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PIN1 Tchem Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (36611 Activities)

Discover Target: PIN1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GMNN Tbio Geminin (128009 Activities)

Discover Target: GMNN

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Impa1 Inositol monophosphatase 1 (16203 Activities)

Discover Target: Impa1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water (partly), chloroform, dichloromethane, ethyl acetate, and methanol.
• Sensibilidad: Heat sensitive
• Punto de fusión (°C): 78-80 °C
• Peso molecular: 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

Referencias

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]