Phenyl dichlorophosphate supplier

Name
Phenyl dichlorophosphate
EINECS 212-220-6
CAS No. 770-12-7
Article Data84
CAS DataBase
Density 1.466 g/cm³
Solubility Decomposes
Melting Point -1 °C
Formula C₆H₅Cl₂O₂P
Boiling Point 242 °C at 760 mmHg
Molecular Weight 210.984
Flash Point 99.1 °C
Transport Information UN 3265 8/PG 2
Appearance colorless transparent liquid
Safety 26-36/37/39-45
Risk Codes 34
Molecular Structure
Hazard Symbols C
Synonyms Phenylphosphorodichloridate (6CI);Dichlorophenoxyphosphineoxide;NSC 44412;Phenoxydichlorophosphine oxide;Phenoxyphosphoryl dichloride;Phosphorodichloridic acid, phenyl ester;Phenylphosphoricdichloride;
PSA 36.11000
LogP 3.65110

Synthetic route

: 3426-89-9
phenyl phosphorodichloridite

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With ozone In dichloromethane at 0℃;	99%

: 108-95-2
phenol

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With triethylamine; trichlorophosphate In tert-butyl methyl ether at -55 - 20℃; for 4h;	98%
With magnesium chloride; trichlorophosphate at 80 - 95℃; for 5h; Large scale;	91.5%
With triethylamine; trichlorophosphate In diethyl ether at -78 - 20℃; Inert atmosphere;	85%

: 139-02-6
sodium phenoxide

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With tetrabutylammomium bromide; trichlorophosphate In toluene for 1h;	90%

: 19579-04-5
tetrachlorophenoxyphosphorane

: 109-92-2
ethyl vinyl ether

A: 770-12-7
O-phenyl phosphorodichloridate

B: phenyl (2-ethoxyvinyl)-phosphonochloridate

Conditions

Conditions	Yield
With sulfur dioxide In benzene at 0 - 5℃;	A 32.5% B 67.1%

...Expand

: 108-95-2
phenol

A: 115-86-6
phosphoric acid triphenyl ester

B: 770-12-7
O-phenyl phosphorodichloridate

C: 2524-64-3
chlorophosphoric acid diphenyl ester

Conditions

Conditions	Yield
With magnesium chloride; trichlorophosphate In xylene at 90 - 110℃; Kinetics; Product distribution; Rate constant;
With trichlorophosphate at 102 - 240℃;

...Expand

phenyl sulfate potassium: phenyl sulfate potassium

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With phosphorus pentachloride

phosphoric acid phenyl ester tetrachloride: phosphoric acid phenyl ester tetrachloride

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With sulfur dioxide

: 108-95-2
phenol

phosphorous oxychloride: phosphorous oxychloride

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With triethylamine In diethyl ether at 0℃; for 0.5h; Yield given;

: 108-95-2
phenol

A: 770-12-7
O-phenyl phosphorodichloridate

B phosphoric acid diphenyl ester chloride , triphenyl phosphate: phosphoric acid diphenyl ester chloride , triphenyl phosphate

Conditions

Conditions	Yield
With trichlorophosphate

: 7719-12-2, 52843-90-0
phosphorus trichloride

: 108-95-2
phenol

A: 770-12-7
O-phenyl phosphorodichloridate

B: 2524-64-3
chlorophosphoric acid diphenyl ester

Conditions

Conditions	Yield
at 140℃;

...Expand

: 660-68-4
diethyl amine hydrochloride

: 108-95-2
phenol

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With trichlorophosphate

: 10025-87-3, 12599-09-6, 63736-95-8
trichlorophosphate

: 108-95-2
phenol

: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
In not given react. of POCl3 with C6H5OH;;
In not given react. of POCl3 with C6H5OH;;

: 108-95-2
phenol

A: 61274-57-5
Phenylchlorophosphonic Acid Phenyl Ester

B: 770-12-7
O-phenyl phosphorodichloridate

Conditions

Conditions	Yield
With titanium tetrachloride; trichlorophosphate at 70 - 90℃; Reagent/catalyst; Temperature; Overall yield = 95 %;

: 770-12-7
O-phenyl phosphorodichloridate

: 701-64-4
phosphoric acid monophenyl ester

Conditions

Conditions	Yield
With silver nitrate In acetonitrile at 0 - 5℃; for 1h; Hydrolysis;	100%
With water at 20℃;
With diethyl ether; water

: 5557-81-3, 5557-83-5, 34404-37-0
L-alanine benzyl ester hydrochloride

: 770-12-7
O-phenyl phosphorodichloridate

: 183370-70-9
phenyl(benzyloxy-L-alaninyl)phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78℃; for 1h; Inert atmosphere;	100%
With triethylamine In dichloromethane at -80 - 20℃;	98%
With triethylamine In dichloromethane at -78 - 20℃; for 2.5h; Inert atmosphere;	95%

: 770-12-7
O-phenyl phosphorodichloridate

: 39613-92-8, 62062-56-0, 62062-65-1
alanine isopropyl ester hydrochloride

: 261909-49-3
phenyl(isopropoxy-L-alaninyl) phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In tert-butyl methyl ether at -65 - -50℃; for 2h; Inert atmosphere; Cooling with acetone-dry ice;	100%
With triethylamine In tert-butyl methyl ether at -55℃; for 2h;	100%
With triethylamine In dichloromethane at -78 - 20℃; for 2.5h; Inert atmosphere;	93%

: 3-((4-cyclobutylbutyl)sulfonyl)propan-1-ol

: 770-12-7
O-phenyl phosphorodichloridate

: 3-((4-cyclobutylbutyl)sulfonyl)propyl phenyl (S)-phosphorochloridate

Conditions

Conditions	Yield
With 2,6-dimethylpyridine In tetrahydrofuran at 0 - 20℃; for 18h;	100%

: 612-14-6
phthalyl alcohol

: 770-12-7
O-phenyl phosphorodichloridate

: 49785-03-7
2-phenoxy-2-oxo-5,6-benzo-1,3,2-dioxaphosphepane

Conditions

Conditions	Yield
With triethylamine In ethyl acetate for 48h;	99.5%

: 770-12-7
O-phenyl phosphorodichloridate

: (S)-1-isopropylallylamine hydrochloride

: 345898-62-6
(NHC6H11)2PO2C6H5

Conditions

Conditions	Yield
With dmap; triethylamine In dichloromethane for 3.5h;	99%
With dmap; triethylamine In dichloromethane Heating;

: 3182-93-2
(L)-phenylalanine ethyl ester hydrochloride

: 770-12-7
O-phenyl phosphorodichloridate

: 287478-21-1
(2S)-ethyl 2-(((RS)-chloro(phenoxy)phosphoryl)amino)-3-phenylpropanoate

Conditions

Conditions	Yield
Stage #1: (L)-phenylalanine ethyl ester hydrochloride; O-phenyl phosphorodichloridate In dichloromethane at -78℃; Inert atmosphere; Stage #2: With triethylamine In dichloromethane at -78 - 20℃;	99%
With triethylamine In dichloromethane at -78 - 20℃;	72%
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h;

: 16652-75-8
L-isoleucine benzyl ester tosylate

: 770-12-7
O-phenyl phosphorodichloridate

: 1184942-63-9
phenyl-(benzoxy-L-isoleucinyl)-phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; Inert atmosphere;	99%

: 39825-33-7
isopropyl L-alanine

: 770-12-7
O-phenyl phosphorodichloridate

: 261909-49-3
phenyl(isopropoxy-L-alaninyl) phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h; Inert atmosphere;	99%
With triethylamine In dichloromethane	78%
With N-ethyl-N,N-diisopropylamine In dichloromethane at -80℃; for 2h;

: 18531-99-2
(S)-[1,1']-binaphthalenyl-2,2'-diol

: 770-12-7
O-phenyl phosphorodichloridate

: C26H17O4P

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 0 - 20℃; for 16h; Inert atmosphere; Sealed tube;	99%
With triethylamine In dichloromethane at 23℃; for 18h;	63%

: 3081-24-1
H-Phe-OEt

: 770-12-7
O-phenyl phosphorodichloridate

: 287478-21-1
(2S)-ethyl 2-(((RS)-chloro(phenoxy)phosphoryl)amino)-3-phenylpropanoate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h; Inert atmosphere;	99%

: 1738-69-8
L-Leucine benzyl ester

: 770-12-7
O-phenyl phosphorodichloridate

: 840506-65-2
phenyl-(benzoxy-L-leucinyl)-phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h; Inert atmosphere;	99%

: 2491-20-5
L-alanine methyl ester hydrochloride

: 770-12-7
O-phenyl phosphorodichloridate

: 142629-80-9
phenyl methoxyalaninyl phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -80 - 20℃;	98%
With triethylamine In dichloromethane at -78 - 20℃; for 1h;	92%
With triethylamine In dichloromethane at -78 - 20℃; for 2.5h; Inert atmosphere;	91%

: 2743-60-4
L-Leucine ethyl ester

: 770-12-7
O-phenyl phosphorodichloridate

: 926308-86-3
phenyl (ethyloxy-L-leucinyl)phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h; Inert atmosphere;	98%

: 921-74-4
L-isoleucine ethyl ester

: 770-12-7
O-phenyl phosphorodichloridate

: 926309-00-4
ethyl (chloro(phenoxy)phosphoryl)-L-isoleucinate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h; Inert atmosphere;	98%

: 16879-02-0
6-chloro-2-hydroxypyridine

: 39825-33-7
isopropyl L-alanine

: 770-12-7
O-phenyl phosphorodichloridate

: C17H20ClN2O5P

Conditions

Conditions	Yield
Stage #1: isopropyl L-alanine; O-phenyl phosphorodichloridate With N-ethyl-N,N-diisopropylamine In dichloromethane at -50 - -5℃; Inert atmosphere; Stage #2: 6-chloro-2-hydroxypyridine With N-ethyl-N,N-diisopropylamine In dichloromethane at -10 - 0℃; Inert atmosphere;	97.5%

...Expand

: 74115-13-2
5-bromopyridine-3-ol

: 39825-33-7
isopropyl L-alanine

: 770-12-7
O-phenyl phosphorodichloridate

: C17H20BrN2O5P

Conditions

Conditions	Yield
Stage #1: isopropyl L-alanine; O-phenyl phosphorodichloridate With triethylamine In dichloromethane at -50 - -5℃; Inert atmosphere; Stage #2: 5-bromopyridine-3-ol With triethylamine In dichloromethane at -10 - 0℃; Inert atmosphere;	97.3%

...Expand

: 355-28-2
2,2,3,3,4,4,5,5,5-nonafluoropentanol

: 770-12-7
O-phenyl phosphorodichloridate

: 70508-50-8
Phosphoric acid bis-(2,2,3,3,4,4,5,5,5-nonafluoro-pentyl) ester phenyl ester

Conditions

Conditions	Yield
With lithium chloride for 4h; bath temperature 180 deg C;	97%
With calcium chloride at 120℃;

: 17368-12-6
2-chloropyridin-4-ol

: 39825-33-7
isopropyl L-alanine

: 770-12-7
O-phenyl phosphorodichloridate

: C17H20ClN2O5P

Conditions

Conditions	Yield
Stage #1: isopropyl L-alanine; O-phenyl phosphorodichloridate With N-ethyl-N,N-diisopropylamine In dichloromethane at -50 - -5℃; Inert atmosphere; Stage #2: 2-chloropyridin-4-ol With N-ethyl-N,N-diisopropylamine In dichloromethane at -10 - 0℃; Inert atmosphere;	97%

...Expand

: 7524-50-7
methyl (2S)-2-amino-3-phenylpropanoate hydrochloride

: 770-12-7
O-phenyl phosphorodichloridate

: 147907-42-4
phenyl methoxyphenylalaninyl phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -70 - 20℃;	96.7%
With triethylamine In dichloromethane at -78 - 20℃;
With triethylamine In dichloromethane at -78 - 20℃;
With triethylamine In dichloromethane at -78 - 20℃;

: 770-12-7
O-phenyl phosphorodichloridate

: 39648-74-3, 65355-00-2, 65355-14-8
(S)-5,5',6,6',7,7',8,8'-octahydro-1,1'-bi-2-naphthol

: C26H25O4P

Conditions

Conditions	Yield
Stage #1: (S)-5,5',6,6',7,7',8,8'-octahydro-1,1'-bi-2-naphthol With sodium hydride In tetrahydrofuran at 0℃; for 0.5h; Inert atmosphere; Sealed tube; Stage #2: O-phenyl phosphorodichloridate In tetrahydrofuran at 0 - 20℃; Inert atmosphere; Sealed tube;	96%

: 71989-43-0
methyl O-(1,1-dimethylethyl)-L-threoninate hydrochloride

: 770-12-7
O-phenyl phosphorodichloridate

: phenyl-(methoxy-O-tert-butyl-L-threoninyl) phosphorochloridate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.5h;	96%

: 55456-40-1
benzyl 2-aminoisobutyrate

: 770-12-7
O-phenyl phosphorodichloridate

: 840506-42-5
benzyl 2-((chloro(phenoxy)phosphoryl)amino)-2-methylpropanoate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at -78 - 20℃; for 1.25h; Inert atmosphere;	96%

: 74115-12-1
5-chloropyridin-3-ol

: 39825-33-7
isopropyl L-alanine

: 770-12-7
O-phenyl phosphorodichloridate

: C17H20ClN2O5P

Conditions

Conditions	Yield
Stage #1: isopropyl L-alanine; O-phenyl phosphorodichloridate With triethylamine In dichloromethane at -50 - -5℃; Inert atmosphere; Stage #2: 5-chloropyridin-3-ol With triethylamine In dichloromethane at -10 - 0℃; Inert atmosphere;	95.7%

...Expand

: 7300-91-6
N-(4-hydroxyphenyl)maleimide

: 770-12-7
O-phenyl phosphorodichloridate

: C26H17N2O8P

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran at 5 - 7℃; Temperature;	95.3%

: 75-89-8
2,2,2-trifluoroethanol

: 770-12-7
O-phenyl phosphorodichloridate

: Phosphoric acid phenyl ester bis-(2,2,2-trifluoro-ethyl) ester

Conditions

Conditions	Yield
With lithium chloride for 8h; bath temperature 160 - 170 deg C;	95.2%
for 24h; Alkaline conditions;

: 770-12-7
O-phenyl phosphorodichloridate

: 108-93-0
cyclohexanol

: dicyclohexyl phenyl phosphate

Conditions

Conditions	Yield
With molybdenum(VI) tetrachloride oxide; triethylamine In dichloromethane at 20℃;	95%
at 70 - 80℃;

: 4383-22-6
Allylbenzylamine

: 770-12-7
O-phenyl phosphorodichloridate

: 920526-13-2
C16H17ClNO2P

Conditions

Conditions	Yield
Stage #1: O-phenyl phosphorodichloridate With dmap; triethylamine In dichloromethane at 20℃; for 0.25h; Stage #2: Allylbenzylamine In dichloromethane at 20℃; for 3h;	95%

Phenyl dichlorophosphate Consensus Reports

Reported in EPA TSCA Inventory.

Phenyl dichlorophosphate Specification

The Phosphorodichloridic acid, phenyl ester, with its CAS registry number 770-12-7, has the IUPAC name of dichlorophosphoryloxybenzene. For being a kind of clear colourless to very slightly brown liquid, it is sensitive to moisture.

The physical properties of this chemical are as below: (1)ACD/LogP: 2.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.46; (4)ACD/LogD (pH 7.4): 2.46; (5)ACD/BCF (pH 5.5): 43.54; (6)ACD/BCF (pH 7.4): 43.54; (7)ACD/KOC (pH 5.5): 518.47; (8)ACD/KOC (pH 7.4): 518.47; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 36.11; (13)Index of Refraction: 1.536; (14)Molar Refractivity: 44.87 cm³; (15)Molar Volume: 143.8 cm³; (16)Polarizability: 17.78×10^-24 cm³; (17)Surface Tension: 45.2 dyne/cm; (18)Density: 1.466 g/cm³; (19)Flash Point: 99.1 °C; (20)Enthalpy of Vaporization: 45.96 kJ/mol; (21)Boiling Point: 242 °C at 760 mmHg; (22)Vapour Pressure: 0.0541 mmHg at 25°C; (23)Exact Mass: 209.940421; (24)MonoIsotopic Mass: 209.940421; (25)Topological Polar Surface Area: 26.3; (26)Heavy Atom Count: 11; (27)Complexity: 162.

Use of this chemical: Phosphorodichloridic acid could react with 4-methyl-aniline to produce phosphoric acid-chloride phenyl ester-p-toluidide. This reaction happens in the presence of the reagent of diethyl ether.

Production method of this chemical: phenol could react to produce phosphorodichloridic acid. This reaction happens in the presence of POCl₃, with its yield of 70.1 %.

As to its usage, it is widely applied in many ways. It could be used as the catalytic agent in the synthesis of Emamectin benzoate; It could also be used to prepare phosphodiesterase and then it is usually applied as the coupling agent of sulfinic acid, alcohol, ammonia and triol.

When you are dealing with this chemical, you should be very careful. For being a kind of corrosive chemical, it is irritating to respiratory system and may destroy living tissue on contact. And it could causes burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. If in case of contact with eyes, rinse immediately with plenty of water and seek medical advice and if in case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)OP(=O)(Cl)Cl
(2)InChI: InChI=1S/C6H5Cl2O2P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H
(3)InChIKey: TXFOLHZMICYNRM-UHFFFAOYSA-N

Below are the toxicity information of this chemical:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mammal (species unspecified)	LD50	oral	850mg/kg (850mg/kg)		Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 39(4), Pg. 86, 1974.

Product Name

Phenyl dichlorophosphate

Synthetic route

Phenyl dichlorophosphate Consensus Reports

Phenyl dichlorophosphate Specification

Related Products

Hot Products