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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; |
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. |