Phosphoric acid triallyl ester

Inquiry

Molecular Formula:

C9H15O4P

Molecular Weight:

218.18

CAS Number:

1623-19-4

Catalog Number:

1623-19-4

Product Information

Molecular Formula:

C9H15O4P

Molecular Weight:

218.18

Description

Phosphoric acid triallyl ester, commonly known as PATE, is an indispensable chemical entity extensively employed in the biomedical sector due to its multifaceted functionality. Being a pivotal constituent in the synthesis of pharmaceutical compounds, particularly those combating cancer and microbial infections, PATE exhibits remarkable efficacy in disease treatment. Moreover, owing to its diverse applicability, ranging from targeted therapy to tumorous growth inhibition, this compound serves as an invaluable asset in the realm of intricate biomedical investigations and the relentless pursuit of novel drug innovations.

Synonyms

AURORA KA-1639; TRIALLYL PHOSPHATE; PHOSPHORIC ACID TRIALLYL ESTER; allylphosphate; Phosphoricacid,tri-2-propenylester; triallylfosfat

IUPAC Name

tris(prop-2-enyl) phosphate

Canonical SMILES

C=CCOP(=O)(OCC=C)OCC=C

InChI

InChI=1S/C9H15O4P/c1-4-7-11-14(10,12-8-5-2)13-9-6-3/h4-6H,1-3,7-9H2

InChI Key

XHGIFBQQEGRTPB-UHFFFAOYSA-N

Boiling Point

251.7ºC at 760mmHg

Purity

N/A

Density

1,08 g/cm³

Solubility

Water solubility = >1 g/L

Appearance

Colorless to Light yellow to Light orange clear liquid

Application

Used as a flame retardant and plasticizer for polymers and fabrics.

Storage

Store under inert gas

Refractive Index

1.45

Vapor Pressure

0.00541 [mmHg]

Computed Properties

XLogP3

1.5

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

218.07079595 g/mol

Monoisotopic Mass

218.07079595 g/mol

Topological Polar Surface Area

44.8Å²

Heavy Atom Count

Formal Charge

Complexity

199

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-114094109-A	Lithium ion battery	2022-01-19
CN-114068936-A	Lithium ion battery	2022-01-14
CN-114188608-A	Novel boron-containing sulfonate non-aqueous electrolyte additive and lithium ion battery prepared from same	2021-12-23
CN-114162056-A	Automobile interior ceiling and manufacturing method thereof	2021-12-15
CN-114142092-A	Electrolyte, electrochemical device and method for stabilizing positive electrode material	2021-11-26
CN-114122512-A	Solid electrolyte, method for preparing the same, and solid secondary battery comprising the same	2021-11-11
CN-114094102-A	Secondary battery	2021-11-03
CN-113851720-A	Non-aqueous electrolyte of lithium ion battery and application thereof	2021-10-29
CN-114024030-A	Non-aqueous electrolyte and battery containing same	2021-10-21
CN-113782834-A	Electrolyte containing phenyl sulfonate compound and lithium ion battery	2021-10-14

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Phosphoric acid triallyl ester

Product Information

Computed Properties

Patents

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