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Diethyl (2-(triethoxysilyl)ethyl)phosphonate

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Name

Diethyl (2-(triethoxysilyl)ethyl)phosphonate

EINECS N/A
CAS No. 757-44-8 Density 1.031
PSA 73.03000 LogP 3.30090
Solubility N/A Melting Point <0°C
Formula C12H29 O6 P Si Boiling Point 141 °C (2 mmHg)
Molecular Weight 328.418 Flash Point 70°C
Transport Information N/A Appearance N/A
Safety Mildly toxic by ingestion. When heated to decomposition it emits toxic vapors of POx. Risk Codes R36/37/38
Molecular Structure Molecular Structure of 757-44-8 (DIETHYLPHOSPHATOETHYLTRIETHOXYSILANE) Hazard Symbols Xi
Synonyms

Phosphonicacid, [2-(triethoxysilyl)ethyl]-, diethyl ester (6CI,7CI,8CI,9CI);Diethoxyphosphorylethyltriethoxysilane; Diethyl[2-(triethoxysilyl)ethane]phosphonate; Diethyl [b-(triethoxysilyl)ethyl]phosphonate

Article Data 4

Diethyl (2-(triethoxysilyl)ethyl)phosphonate Synthetic route

78-08-0

Triethoxyvinylsilane

762-04-9

phosphonic acid diethyl ester

757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

Conditions
ConditionsYield
With 2,2'-azobis(isobutyronitrile) at 120℃; for 1h;38%
With di-tert-butyl peroxide
With di-tert-butyl peroxide
18279-67-9

2-chloroethyltriethoxysilane

122-52-1

triethyl phosphite

757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

dihydroxyphosphorylethyltrihydroxysilane

Conditions
ConditionsYield
With hydrogenchloride at 90℃; for 24h;100%
757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

C6H14F4O3PSi(1-)*H3N*H(1+)

Conditions
ConditionsYield
With ammonium hydrogen difluoride In water at 20℃;99%
17455-13-9

18-crown-6 ether

757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

C48H112O36P8Si8*F(1-)*C12H24KO6(1+)

Conditions
ConditionsYield
Stage #1: 18-crown-6 ether With potassium fluoride In toluene; acetonitrile at 20℃; for 0.25h; Inert atmosphere;
Stage #2: diethyl [2-(triethoxysilyl)ethyl]phosphonate In water; toluene; acetonitrile at 20℃; Inert atmosphere;
89%
757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

429-41-4

tetrabutyl ammonium fluoride

1393730-74-9

tetra-n-butylammonium octakis(diethylphosphatoethyl)octasilsesquioxane fluoride

Conditions
ConditionsYield
In tetrahydrofuran; water; toluene at 25℃; for 16h; Solvent; Inert atmosphere;82%
757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

C6H14F4O3PSi(1-)*K(1+)

Conditions
ConditionsYield
With potassium hydrogen bifluoride In water; acetone at 20℃; for 0.166667h;77%
757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

diethyl [2-(trifluorosilyl)ethyl]phosphonate

Conditions
ConditionsYield
With boron trifluoride diethyl etherate Heating;44.4%
122-20-3

triisopropanolamine

757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

71682-51-4

[2-(3,7,10-trimethyl-2,8,9-trioxa-5-aza-1-sila-bicyclo[3.3.3]undec-1-yl)-ethyl]-phosphonic acid diethyl ester

Conditions
ConditionsYield
Irradiation;
78-10-4

tetraethoxy orthosilicate

757-44-8

diethyl [2-(triethoxysilyl)ethyl]phosphonate

Polymer, co-polymerisation by sol-gel method Monomer(s): (EtO)4Si, 4; (EtO)3Si(CH2)2PO(OEt)2, 1

Polymer, co-polymerisation by sol-gel method Monomer(s): (EtO)4Si, 4; (EtO)3Si(CH2)2PO(OEt)2, 1

Conditions
ConditionsYield
With hydrogenchloride In ethanol for 24h;

Diethyl (2-(triethoxysilyl)ethyl)phosphonate Chemical Properties

Molecular Formula: C12H29O6PSi
Molar mass: 328.41 g/mol
EINECS: 212-056-5
Index of Refraction: 1.428 
Density: 1.031 g/cm3
Flash Point: 159.1 °C
Enthalpy of Vaporization: 55.99 kJ/mol
Boiling Point: 339.5 °C at 760 mmHg
Vapour Pressure: 0.00018 mmHg at 25 °C
Melting point: <0 °C
Appearance: Clear colorless liquid
Structure of Diethyl (2-(triethoxysilyl)ethyl)phosphonate (CAS NO.757-44-8):
               

Diethyl (2-(triethoxysilyl)ethyl)phosphonate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 16mL/kg (16mL/kg)   Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974.
rat LD50 oral 17200uL/kg (17.2mL/kg)   Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974.

Carcinogenicity of Diethyl (2-(triethoxysilyl)ethyl)phosphonate (CAS NO.757-44-8) hasn't been listed as a carcinogen by NTP, IARC,ACGIH, or CA Prop 65. And its toxicological properties have not been fully investigated.You can see actual entry in RTECS for complete information.

Diethyl (2-(triethoxysilyl)ethyl)phosphonate Consensus Reports

Reported in EPA TSCA Inventory.

Diethyl (2-(triethoxysilyl)ethyl)phosphonate Safety Profile

Mildly toxic by ingestion. When heated to decomposition it emits toxic vapors of POx.
 

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 37/39-26 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S37/39:Wear suitable gloves and eye/face protection.

Diethyl (2-(triethoxysilyl)ethyl)phosphonate Specification

 Diethyl (2-(triethoxysilyl)ethyl)phosphonate ,its cas register number is 757-44-8. It also can be called Phosphonic acid, P-(2-(triethoxysilyl)ethyl)-, diethyl ester or Phosphonic acid, (2-(triethoxysilyl)ethyl)-, diethyl ester . It is hazardous,so the first aid measures and others should be known. Such as: When on the skin: first,should flush skin with plenty of water immediately for at least 15 minutes while removing contaminated clothing. Secondly,Get medical aid. Or in the eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Then get medical aid soon. While ,it's Inhaled: Remove from exposure and move to fresh air immediately.Give artificial respiration while not breathing. When breathing is difficult, give oxygen. And as soon as to get medical aid. Then you have the ingesting of the product : Wash mouth out with water,and get medical aid immediately.Notes to physician: Treat supportively and symptomatically.
In addition, Diethyl (2-(triethoxysilyl)ethyl)phosphonate (CAS NO.757-44-8) can be stable under normal temperature and pressure conditions.It is not compatible with strong oxidizing agents, and you must not take it with  incompatible materials. And also prevent it to broken down into hazardous decomposition products: carbon monoxide, oxides of phosphorus, carbon dioxide.

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