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12789-46-7

Basic Information
CAS No.: 12789-46-7
Name: Pentyl dihydrogen phosphate
Molecular Structure:
Molecular Structure of 12789-46-7 (Pentyl dihydrogen phosphate)
Formula: C5H13O4P
Molecular Weight: 168.15
Synonyms: Phosphoric acid pentyl ester
EINECS: 235-827-8
Density: 1.23g/cm3
Boiling Point: 285.6°Cat760mmHg
Flash Point: 126.5°C
Appearance: Powder
Safety: Corrosive and irritating to the skin, eyes, and mucous membranes. When heated to decomposition it emits toxic fumes of POx. See also ESTERS.
PSA: 76.57000
LogP: 1.28590
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Chemistry

IUPAC Name: Pentyl dihydrogen phosphate
Synonyms of Pentyl ester phosphoric acid (CAS NO.12789-46-7) : Pentyl dihydrogen phosphate ; Phosphoric acid, monopentyl ester ; Amyl acid phosphate ; Amyl dihydrogen phosphate
CAS NO:  12789-46-7
Molecular Formula:C5H13O4P                    
Molecular Weight :168.1281                  
Molecular Structure :
EINECS: 235-827-8
Index of Refraction: 1.452   
Surface Tension: 46.3 dyne/cm 
Density: 1.23 g/cm3 
Flash Point: 126.5 °C 
Enthalpy of Vaporization: 57.73 kJ/mol 
Boiling Point: 285.6 °C at 760 mmHg 
Vapour Pressure: 0.000714 mmHg at 25°C 
Appearance: Pentyl ester phosphoric acid (CAS NO.12789-46-7) is a colorless liquid.
Water solubility:Insoluble in water.

Uses

 Pentyl ester phosphoric acid (CAS NO.12789-46-7) is used as a curing agent in paints and plastics and in the manufacture of synthetic fibers.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 250mg/kg (250mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 37, 1953.

Safety Profile

Corrosive and irritating to the skin, eyes, and mucous membranes. When heated to decomposition it emits toxic fumes of POx. See also ESTERS.

RIDADR 2819
HazardClass 8
PackingGroup III

Standards and Recommendations

DOT Classification:  8; Label: Corrosive

Specification

1.General Description : Burns, though difficult to ignite. Denser than water and is insoluble in water. Hence, sinks in water. Corrosive to metals and tissue. Vapors are heavier than air. Used as a curing agent in paints and plastics and in the manufacture of synthetic fibers.
2.Reactivity Profile :Pentyl dihydrogen phosphate is an organophosphate. Organophosphates are susceptible to formation of highly toxic and flammable phosphine gas in the presence of strong reducing agents such as hydrides. Partial oxidation by oxidizing agents may result in the release of toxic phosphorus oxides.
3.Health Hazard :TOXIC; inhalation, ingestion or skin contact with material may cause severe injury or death. Contact with molten substance may cause severe burns to skin and eyes. Avoid any skin contact. Effects of contact or inhalation may be delayed. Fire may produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may be corrosive and/or toxic and cause pollution.
4.Fire Hazard :Combustible material: may burn but does not ignite readily. When heated, vapors may form explosive mixtures with air: indoors, outdoors and sewers explosion hazards. Contact with metals may evolve flammable hydrogen gas. Containers may explode when heated. Runoff may pollute waterways. Substance may be transported in a molten form.