Conditions | Yield |
---|---|
With Cumene hydroperoxide; cumene hydroperoxide sodium salt In toluene Ambient temperature; | 90% |
With sodium hydroxide In water Rate constant; variation of surfactants; | |
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Mechanism; Equilibrium constant; |
Conditions | Yield |
---|---|
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Mechanism; Equilibrium constant; |
Conditions | Yield |
---|---|
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Mechanism; Equilibrium constant; |
(E)-O-(2,4-dinitrophenyl)benzaldoxime
A
sodium 2,4-dinitrophenoxide
B
benzonitrile
Conditions | Yield |
---|---|
With sodium methylate In methanol at 25℃; Rate constant; Kinetics; Mechanism; isotope effect; other (E)-O-arylbenzaldoximes; |
O-(2,4-dinitrophenyl)-p-nitrobenzaldoxime
A
sodium 2,4-dinitrophenoxide
B
4-nitrobenzonitrile
Conditions | Yield |
---|---|
With sodium methylate In methanol at 25℃; Rate constant; |
4-methoxy-benzaldehyde-[O-(2,4-dinitro-phenyl)-seqtrans-oxime ]
A
sodium 2,4-dinitrophenoxide
B
4-methoxybenzonitrile
Conditions | Yield |
---|---|
With sodium methylate In methanol at 25℃; Rate constant; |
2,4-Dinitrofluorobenzene
benzyl alcohol
A
1-(benzyloxy)-2,4-dinitrobenzene
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydroxide In octane; water at 25℃; |
propan-1-ol
tert-Amyl alcohol
pentan-1-ol
2,4-Dinitrofluorobenzene
tert-butyl alcohol
A
tert-Butyl-2,4-dinitrophenylether
B
1,1-Dimethylpropyl-2,4-dinitrophenolat
C
1-propoxy-2,4-dinitrobenzene
D
(2,4-dinitro-phenyl)-pentyl ether
E
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With potassium hydroxide; sodium hydroxide; cetyltrimethylammonim bromide In octane; water at 25℃; Kinetics; Product distribution; |
3-Bromo-benzaldehyde O-(2,4-dinitro-phenyl)-oxime
A
3-cyanobromobenzene
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium methylate In methanol at 25℃; Rate constant; |
Conditions | Yield |
---|---|
With sodium methylate In methanol at 25℃; Rate constant; |
1-chloro-2,4-dinitro-benzene
butan-1-ol
A
n-Butyl 2,4-dinitrophenyl ether
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With cetyltrimethylammonim bromide In octane; water at 25℃; Kinetics; Product distribution; |
Conditions | Yield |
---|---|
With sodium hydroxide In water Rate constant; variation of surfactants and hydroxide ion concentration; | |
With hydroxide In water at 25℃; Rate constant; variation of surfactants and hydroxide ion concentration; | |
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Mechanism; Equilibrium constant; |
N,N-dimethyl-formamide
1-chloro-2,4-dinitro-benzene
A
N,N-dimethyl-2,4-dinitroaniline
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydride; 5-amino-3-methylthio-1,2,4-triazole 1.) 0 deg C, 1 h, 2.) 60 deg C, 2 h; Yield given. Multistep reaction. Yields of byproduct given; |
5-amino-3-methylthio-1,2,4-triazole
1-chloro-2,4-dinitro-benzene
A
N,N-dimethyl-2,4-dinitroaniline
B
sodium 2,4-dinitrophenoxide
C
5-amino-1-(2,4-dinitrophenyl)-3-methylthio-1H-1,2,4-triazole
Conditions | Yield |
---|---|
With sodium hydride 1.) DMF, 0 deg C, 1 h, 2.) DMF, 60 deg C, 2 h; Yield given. Multistep reaction. Yields of byproduct given; |
5-amino-3-methylthio-1,2,4-triazole
1-chloro-2,4-dinitro-benzene
A
N,N-dimethyl-2,4-dinitroaniline
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydride 1.) DMF, 0 deg C, 1 h, 2.) DMF, 60 deg C, 2 h; Yield given. Multistep reaction. Yields of byproduct given; |
5-amino-3-methylthio-1,2,4-triazole
1-chloro-2,4-dinitro-benzene
A
N,N-dimethyl-2,4-dinitroaniline
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydride 1.) DMF, 0 deg C, 1 h, 2.) DMF, 60 deg C, 2 h; Yield given. Multistep reaction. Yields of byproduct given; |
1-chloro-2,4-dinitro-benzene
A
N,N-dimethyl-2,4-dinitroaniline
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydride; 5-amino-3-methylthio-1,2,4-triazole 1.) DMF, 0 deg C, 1 h, 2.) DMF, 60 deg C, 2 h; Yield given. Multistep reaction. Yields of byproduct given; |
Conditions | Yield |
---|---|
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Equilibrium constant; other alkali metal hydroxides; |
A
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydroxide In dimethyl sulfoxide at 25℃; Rate constant; Equilibrium constant; other alkali metal hydroxides; |
1-(2,4-dinitrophenyl)-1-aza-4,7,10,13-tetraoxapentadecane
A
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Equilibrium constant; other alkali metal hydroxides; |
A
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydroxide In water; dimethyl sulfoxide at 25℃; Rate constant; Equilibrium constant; other alkali metal hydroxides; |
A
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
In neat (no solvent) Product distribution; Mechanism; Heating; thermal stability; |
O2-(2,4-dinitrophenyl) 1-(N,N-diethylamino)diazen-1-ium-1,2-diolate
A
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With sodium hydroxide In methanol at 25℃; Kinetics; Thermodynamic data; Further Variations:; Temperatures; |
B
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With ethylenediaminetetraacetic acid; sodium taurocholate at 37℃; for 0.75h; Kinetics; aq. phosphate buffer; |
bis(2,4-dinitrophenyl)phosphate
A
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With C38H45N4O6Zn2(1+)*ClO4(1-); sodium perchlorate; water In acetonitrile at 25℃; pH=7.5; Kinetics; Reagent/catalyst; pH-value; Glovebox; Schlenk technique; |
Conditions | Yield |
---|---|
Stage #1: 4BF4(1-)*C86H162N6O2(4+) With cobalt(II) acetate In ethanol at 20℃; for 3h; Stage #2: 2,4-Dinitrophenol With oxygen In dichloromethane for 3h; Stage #3: sodium 2,4-dinitrophenoxide With oxygen In dichloromethane Product distribution / selectivity; | 100% |
2,4-Dinitrophenol
cobalt(II) acetate
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
Stage #1: C36H58N4O2(2+)*2BF4(1-); cobalt(II) acetate In ethanol at 20℃; for 2h; Glovebox; Inert atmosphere; Schlenk technique; Stage #2: 2,4-Dinitrophenol With oxygen In dichloromethane for 2h; Stage #3: sodium 2,4-dinitrophenoxide In dichloromethane at 20℃; | 100% |
2,4-Dinitrophenol
cobalt(II) acetate
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
Stage #1: C36H52N4O2(2+)*2BF4(1-); cobalt(II) acetate In ethanol at 20℃; for 2h; Glovebox; Inert atmosphere; Schlenk technique; Stage #2: 2,4-Dinitrophenol With oxygen In dichloromethane for 2h; Stage #3: sodium 2,4-dinitrophenoxide In dichloromethane at 20℃; | 100% |
Conditions | Yield |
---|---|
With 5%-palladium/activated carbon; hydrogen at 70℃; under 4500.45 Torr; for 2h; Temperature; Pressure; Time; Autoclave; | 97.1% |
Isopropenyl chloroformate
sodium 2,4-dinitrophenoxide
Carbonic acid 2,4-dinitro-phenyl ester isopropenyl ester
Conditions | Yield |
---|---|
In acetonitrile Ambient temperature; | 87% |
2,4-Dinitrophenol
cobalt(II) acetate
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
Stage #1: C38H62N4O2(2+)*2BF4(1-); cobalt(II) acetate In methanol at 20℃; for 2h; Inert atmosphere; Schlenk technique; Glovebox; Stage #2: 2,4-Dinitrophenol With oxygen In dichloromethane for 2h; Schlenk technique; Glovebox; Stage #3: sodium 2,4-dinitrophenoxide In dichloromethane at 20℃; Schlenk technique; Glovebox; | 85.84% |
2,4-Dinitrophenol
cobalt(II) acetate
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
Stage #1: C34H56N4O2(2+)*2BF4(1-); cobalt(II) acetate In methanol at 20℃; for 6h; Inert atmosphere; Schlenk technique; Glovebox; Stage #2: 2,4-Dinitrophenol With oxygen In dichloromethane at 20℃; for 12h; Inert atmosphere; Schlenk technique; Glovebox; Stage #3: sodium 2,4-dinitrophenoxide In dichloromethane for 24h; Inert atmosphere; Schlenk technique; Glovebox; | 82.2% |
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
In water Co complex dissolved in hot H2O by stirring; mixed with soln. of Na saltof ligand in hot H2O with stirring; ppt. washed with ice-cold H2O; air dried; elem. anal.; | 79% |
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
In water byproducts: NaCl; addn. of soln. of phenolate deriv. to aq. soln. of cobalt compd.; filtration, washing with cold water, drying in air, recrystn. by keepingsoln. in water and acetone at room temp. for 2 ds, drying in air, elem. anal.; | 75% |
sodium 2,4-dinitrophenoxide
2,4-dinitrophenyl-3,4,6-tri-O-acetyl-2-fluoro-2-deoxy-β-D-galactopyranoside
Conditions | Yield |
---|---|
In acetonitrile Heating; | 61% |
Conditions | Yield |
---|---|
N,N,N,N,-tetramethylethylenediamine In benzene at 25℃; for 4h; | 50% |
N,N,N,N,-tetramethylethylenediamine In benzene at 25℃; for 4h; Rate constant; different mol ratio of reactants and various solublizing agent; in the presence and absence of TEMEDA or tertiary amine as phase transfer catalysts.; | 50% |
With Aliquat 336 In benzene at 25℃; Rate constant; | |
With didecyldimethylammonium chloride In benzene at 25℃; Rate constant; | |
With tetrabutyl-ammonium chloride In benzene at 25℃; Rate constant; |
sodium 2,4-dinitrophenoxide
N-(4-Chlor-phenylsulfonyl)iminothiokohlensaeuremethylester-chlorid
4-Chloro-N-[1-(2,4-dinitro-phenoxy)-1-methylsulfanyl-meth-(Z)-ylidene]-benzenesulfonamide
Conditions | Yield |
---|---|
In benzene for 4h; Heating; | 46% |
N-(p-Toluensulfonyl)iminothiokohlensaeuremethylester-chlorid
sodium 2,4-dinitrophenoxide
N-[1-(2,4-Dinitro-phenoxy)-1-methylsulfanyl-meth-(Z)-ylidene]-4-methyl-benzenesulfonamide
Conditions | Yield |
---|---|
In benzene for 4h; Heating; | 41% |
sodium 2,4-dinitrophenoxide
5-Acetyl-4-chloro-6-methyl-2-phenyl-pyrimidine
1-[4-(2,4-Dinitro-phenoxy)-6-methyl-2-phenyl-pyrimidin-5-yl]-ethanone
Conditions | Yield |
---|---|
In ethanol for 2h; Heating; | 40% |
sodium 2,4-dinitrophenoxide
2-chloro-2-oxo-cis-4,6-dimethyl-1,3,2λ5-dioxaphosphorinane
2-(2,4-dinitrophenoxy)-2-oxo-cis-4,6-dimethyl-1,3,2λ5-dioxaphosphorinane
Conditions | Yield |
---|---|
In toluene at 90℃; for 0.0833333h; | 30.1% |
sodium 2,4-dinitrophenoxide
Acetic acid (2R,3S,4R,5R,6R)-3-acetoxy-2-acetoxymethyl-5-acetylamino-6-chloro-tetrahydro-pyran-4-yl ester
2,4-dinitrophenyl 2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-D-glucopyranoside
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide for 64h; Ambient temperature; | 9% |
phosgene
N,N-bis(2-chloro-n-propyl)amine
sodium 2,4-dinitrophenoxide
N,N-Bis-(2-chlorpropyl)-2,4-dinitrophenyl-carbamat
Conditions | Yield |
---|---|
(i) PhNMe2, toluene, (ii) /BRN= 1736481/, Et3N, CHCl3; Multistep reaction; |
2-(chloromethyl)-2-methyl-1,3-propanediol
sodium 2,4-dinitrophenoxide
5-Chloromethyl-2-(2,4-dinitro-phenoxy)-5-methyl-[1,3,2]dioxaphosphinane 2-sulfide
Conditions | Yield |
---|---|
(i) PSCl3, Py, Et2O, (ii) /BRN= 3782558/, MeCN; Multistep reaction; |
2-chloro-2-oxo-1,3,2-dioxaphosphorinane
sodium 2,4-dinitrophenoxide
2-(2,4-Dinitrophenoxy)-<1.3.2>dioxaphosphorinan-2-oxid
Conditions | Yield |
---|---|
In toluene |
sodium 2,4-dinitrophenoxide
1-chloro-2-phospholene 1-oxide
1-(2,4-dinitro-phenoxy)-2,3-dihydro-1H-phosphole 1-oxide
chloro-trimethyl-silane
sodium 2,4-dinitrophenoxide
2,4-dinitrophenoxy-trimethylsilane
Conditions | Yield |
---|---|
In acetonitrile at 25℃; Thermodynamic data; heat of reaction; |
triisopropylsilyl chloride
sodium 2,4-dinitrophenoxide
Conditions | Yield |
---|---|
With 15-crown-5 In tetrahydrofuran at 25℃; Rate constant; Thermodynamic data; withot reagent; heat of reaction; |
Conditions | Yield |
---|---|
In acetonitrile at 25℃; Thermodynamic data; heat of reaction; |
sodium 2,4-dinitrophenoxide
2-chloro-2-oxo-5,6-tetramethylene-1,3,2-dioxaphosphorinane
2-(2,4-dinitrophenoxy)-2-oxo-trans-5,6-tetramethylene-1,3,2-dioxaphosphorinane
2-(2,4-dinitrophenoxy)-2-oxo-trans-5,6-tetramethylene-1,3,2-dioxaphosphorinane
Conditions | Yield |
---|---|
In toluene at 90℃; for 0.0666667h; | |
In toluene at 90℃; |
Content(%): ≥70
Purity(%): ≥98.0
The Sodium 2,4-dinitrophenate is an organic compound with the formula C6H3N2NaO5. The IUPAC name of this chemical is sodium 2,4-dinitrophenolate. With the CAS registry number 1011-73-0, it is also named as phenol, 2,4-dinitro-, sodium salt (1:1). The product's category is Intermediates of Dyes and Pigments.
Physical properties about Sodium 2,4-dinitrophenate are: (1)ACD/LogP: 1.74; (2)ACD/LogD (pH 5.5): 0.27; (3)ACD/LogD (pH 7.4): -1.21; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 7.19; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 111.87 Å2; (12)Flash Point: 142.8 °C; (13)Enthalpy of Vaporization: 57.51 kJ/mol; (14)Boiling Point: 312.1 °C at 760 mmHg; (15)Vapour Pressure: 0.000294 mmHg at 25°C.
Preparation: this chemical can be prepared by 1-fluoro-2,4-dinitro-benzene. This reaction will need reagent NaOH and solvent H2O.
Uses of Sodium 2,4-dinitrophenate: it can be used to produce benzoic acid-(2,4-dinitro-phenyl ester) at temperature of 25 °C. It will need reagent tricaprylmethylammonium chloride and solvent benzene.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].O=[N+]([O-])c1cc(ccc1[O-])[N+]([O-])=O
(2)InChI: InChI=1/C6H4N2O5.Na/c9-6-2-1-4(7(10)11)3-5(6)8(12)13;/h1-3,9H;/q;+1/p-1
(3)InChIKey: JMOHQJVXBQAVNW-REWHXWOFAB
(4)Std. InChI: InChI=1S/C6H4N2O5.Na/c9-6-2-1-4(7(10)11)3-5(6)8(12)13;/h1-3,9H;/q;+1/p-1
(5)Std. InChIKey: JMOHQJVXBQAVNW-UHFFFAOYSA-M
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
cat | LDLo | intramuscular | 25mg/kg (25mg/kg) | VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION | Journal of Pharmacology and Experimental Therapeutics. Vol. 48, Pg. 410, 1933. |
cat | LDLo | subcutaneous | 25mg/kg (25mg/kg) | VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION | Journal of Pharmacology and Experimental Therapeutics. Vol. 48, Pg. 410, 1933. |
dog | LDLo | intramuscular | 25mg/kg (25mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | Journal of Pharmacology and Experimental Therapeutics. Vol. 48, Pg. 410, 1933. |
dog | LDLo | intravenous | 20mg/kg (20mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 50, Pg. 20, 1935. |
dog | LDLo | oral | 30mg/kg (30mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 49, Pg. 187, 1933. | |
dog | LDLo | subcutaneous | 25mg/kg (25mg/kg) | VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION | Journal of Pharmacology and Experimental Therapeutics. Vol. 48, Pg. 410, 1933. |
mouse | LD50 | subcutaneous | 50mg/kg (50mg/kg) | PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION SKIN AND APPENDAGES (SKIN): HAIR: OTHER | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 56, Pg. 23, 1960. |
pigeon | LDLo | intramuscular | 15mg/kg (15mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 49, Pg. 187, 1933. | |
pigeon | LDLo | intravenous | 15mg/kg (15mg/kg) | BEHAVIORAL: EXCITEMENT LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 50, Pg. 20, 1935. |
rabbit | LDLo | intramuscular | 20mg/kg (20mg/kg) | LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | Journal of Pharmacology and Experimental Therapeutics. Vol. 48, Pg. 410, 1933. |
rabbit | LDLo | subcutaneous | 60mg/kg (60mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 49, Pg. 187, 1933. | |
rat | LDLo | subcutaneous | 15mg/kg (15mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 48, Pg. 410, 1933. |
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