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87-39-8

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87-39-8 Usage

Chemical Properties

LIGHT YELLOW CRYSTALLINE POWDER

Uses

Different sources of media describe the Uses of 87-39-8 differently. You can refer to the following data:
1. Analytical reagent for chromatographic separation of cations. Forms chelates: Leermakers, Hoffman, J. Am. Chem. Soc. 80, 5663 (1958).
2. Violuric Acid, can be used for the synthesis of some novel pyrimidines fused aza-heterocycles, having broad spectrum of pharmacological activities, such as 2-Methyloxazolo[5,4-d]pyrimidine-5,7(4H,6H)-dione (M324600).

Flammability and Explosibility

Notclassified

Check Digit Verification of cas no

The CAS Registry Mumber 87-39-8 includes 5 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 2 digits, 8 and 7 respectively; the second part has 2 digits, 3 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 87-39:
(4*8)+(3*7)+(2*3)+(1*9)=68
68 % 10 = 8
So 87-39-8 is a valid CAS Registry Number.
InChI:InChI=1/C4H3N3O4/c8-2-1(7-11)3(9)6-4(10)5-2/h11H,(H2,5,6,8,9,10)

87-39-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name Violuric Acid Monohydrate

1.2 Other means of identification

Product number -
Other names 2,4,5,6(1H,3H)-Pyrimidinetetrone, 5-oxime

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:87-39-8 SDS

87-39-8Synthetic route

BARBITURIC ACID
67-52-7

BARBITURIC ACID

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydrogenchloride; sodium hydroxide; sodium nitrite In water at 10 - 30℃; for 16h; Reagent/catalyst;85.2%
With potassium nitrite
With sodium perchlorate; sodium nitrite at 25℃; Kinetics; Mechanism; Concentration; pH-value; Reagent/catalyst; Acidic aq. solution;
BARBITURIC ACID
67-52-7

BARBITURIC ACID

n-Amyl nitrite
463-04-7

n-Amyl nitrite

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydrogenchloride
pyrimidine-2,4,5,6(1H,3H)-tetraone
61066-33-9, 61066-34-0, 61066-35-1, 61127-23-9

pyrimidine-2,4,5,6(1H,3H)-tetraone

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydroxylamine hydrochloride; water
With hydroxylamine hydrochloride; water at 60 - 70℃;
uric Acid
69-93-2

uric Acid

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydrogenchloride; potassium chlorate man erwaermt die von ueberschuessigem Chlor befreite Loesung mit salzsaurem Hydroxylamin;
alloxan-4-oxime
74646-24-5

alloxan-4-oxime

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydrogenchloride
[5,5']bipyrimidinyl-2,4,6,2',4',6'-hexaone
476-61-9

[5,5']bipyrimidinyl-2,4,6,2',4',6'-hexaone

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With nitric acid
With potassium nitrite; acetic acid
With cis-nitrous acid
Alloxantin
76-24-4

Alloxantin

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydroxylamine hydrochloride; water
hydrogenchloride
7647-01-0

hydrogenchloride

4,6-diamino-pyrimidine-2,5-dione-5-oxime

4,6-diamino-pyrimidine-2,5-dione-5-oxime

violuric acid
87-39-8

violuric acid

6-amini-5-nitroso-1H-pyrimidine-2,4-dione

6-amini-5-nitroso-1H-pyrimidine-2,4-dione

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydrogenchloride
diliturate iron

diliturate iron

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With potassium cyanide
dilituric acid

dilituric acid

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With glycerol
water
7732-18-5

water

Alloxantin
76-24-4

Alloxantin

hydroxylamine hydrochloride

hydroxylamine hydrochloride

violuric acid
87-39-8

violuric acid

BARBITURIC ACID
67-52-7

BARBITURIC ACID

dinitrogen trioxide
10544-73-7

dinitrogen trioxide

violuric acid
87-39-8

violuric acid

5-nitroso-6-aminopyrimidine
412341-12-9

5-nitroso-6-aminopyrimidine

violuric acid
87-39-8

violuric acid

Conditions
ConditionsYield
With hydrogenchloride; water
1-(2-aminoethyl)pyrrolidine
7154-73-6

1-(2-aminoethyl)pyrrolidine

violuric acid
87-39-8

violuric acid

2-pyrrolidin-1-yl-ethylammonium bis(violurate)

2-pyrrolidin-1-yl-ethylammonium bis(violurate)

Conditions
ConditionsYield
In methanol; water90%
violuric acid
87-39-8

violuric acid

1-Adamantanamine
768-94-5

1-Adamantanamine

C10H17N*C4H3N3O4

C10H17N*C4H3N3O4

Conditions
ConditionsYield
In ethanol73%
violuric acid
87-39-8

violuric acid

tert-butylamine
75-64-9

tert-butylamine

C4H11N*C4H3N3O4

C4H11N*C4H3N3O4

Conditions
ConditionsYield
In ethanol Reflux;72%
violuric acid
87-39-8

violuric acid

4,5-dimethyl-1,2-phenylenediamine
3171-45-7

4,5-dimethyl-1,2-phenylenediamine

C8H12N2*C4H3N3O4

C8H12N2*C4H3N3O4

Conditions
ConditionsYield
In ethanol71%
violuric acid
87-39-8

violuric acid

2-aminoanthracene
613-13-8

2-aminoanthracene

4H-2,4,5,14-Tetraaza-pentaphene-1,3-dione
196872-60-3

4H-2,4,5,14-Tetraaza-pentaphene-1,3-dione

Conditions
ConditionsYield
In acetic acid for 3h; Heating;70%
violuric acid
87-39-8

violuric acid

ammonium pyrimidine-2,4-5,6(1H,3H)-tetrone 5-oximate
1052111-61-1

ammonium pyrimidine-2,4-5,6(1H,3H)-tetrone 5-oximate

Conditions
ConditionsYield
With ammonium carbonate In water70%
violuric acid
87-39-8

violuric acid

triethylamine
121-44-8

triethylamine

C6H15N*2C4H3N3O4

C6H15N*2C4H3N3O4

Conditions
ConditionsYield
In ethanol; water70%
violuric acid
87-39-8

violuric acid

Cyclopropylamine
765-30-0

Cyclopropylamine

cyclopropylammonium violurate

cyclopropylammonium violurate

Conditions
ConditionsYield
In ethanol66%
violuric acid
87-39-8

violuric acid

diethylamine
109-89-7

diethylamine

C4H11N*C4H3N3O4

C4H11N*C4H3N3O4

Conditions
ConditionsYield
In ethanol Reflux;61%
violuric acid
87-39-8

violuric acid

diisopropylamine
108-18-9

diisopropylamine

C6H15N*C4H3N3O4

C6H15N*C4H3N3O4

Conditions
ConditionsYield
In ethanol61%
violuric acid
87-39-8

violuric acid

triethylamine
121-44-8

triethylamine

triethylammonium violurate

triethylammonium violurate

Conditions
ConditionsYield
In ethanol61%
rhenium(I) pentacarbonyl chloride
14099-01-5

rhenium(I) pentacarbonyl chloride

violuric acid
87-39-8

violuric acid

water
7732-18-5

water

fac-(5-hydroxyamino-pyrimidine-2,4,6(1H,3H,5H)-trione)aquatricarbonylrhenium(I) hemihydrate

fac-(5-hydroxyamino-pyrimidine-2,4,6(1H,3H,5H)-trione)aquatricarbonylrhenium(I) hemihydrate

Conditions
ConditionsYield
In methanol stoich., ligand and Re complex reacted in CH3OH at 50-60°C under stirring for 3 h; pptd.(hexane), filtered, washed (EtOH, Et2O), dried (air), recrystd.(acetone/H2O 1:1), elem. anal.;60%
violuric acid
87-39-8

violuric acid

N1-isobutyl-4-methylbenzene-1,3-diamine
1020084-54-1

N1-isobutyl-4-methylbenzene-1,3-diamine

C15H17N5O2
1020084-55-2

C15H17N5O2

Conditions
ConditionsYield
With acetic acid for 0.75h; Heating;58%
violuric acid
87-39-8

violuric acid

N-butylanthracen-2-amine

N-butylanthracen-2-amine

5-butylanthra[1,2-g]pteridine-1,3(2H,5H)-dione

5-butylanthra[1,2-g]pteridine-1,3(2H,5H)-dione

Conditions
ConditionsYield
With acetic acid Reflux;58%
violuric acid
87-39-8

violuric acid

naphthalen-2-ylamine
91-59-8

naphthalen-2-ylamine

8H-naphtho[1,2-g]pteridine-9,11-dione
4707-30-6

8H-naphtho[1,2-g]pteridine-9,11-dione

Conditions
ConditionsYield
at 155℃; for 0.75h;57%
pyrrolidine
123-75-1

pyrrolidine

violuric acid
87-39-8

violuric acid

C4H9N*C4H3N3O4

C4H9N*C4H3N3O4

Conditions
ConditionsYield
In ethanol55%
violuric acid
87-39-8

violuric acid

N,N,N,N,-tetramethylethylenediamine
110-18-9

N,N,N,N,-tetramethylethylenediamine

C6H16N2*C4H3N3O4

C6H16N2*C4H3N3O4

Conditions
ConditionsYield
In ethanol53%
violuric acid
87-39-8

violuric acid

N-butylpyren-4-amine

N-butylpyren-4-amine

9-butylpyreno[4,5-g]pteridine-11,13(9H,12H)-dione

9-butylpyreno[4,5-g]pteridine-11,13(9H,12H)-dione

Conditions
ConditionsYield
With acetic acid Reflux;47%
violuric acid
87-39-8

violuric acid

2-(but-1-ylamino)naphthalene
6270-18-4

2-(but-1-ylamino)naphthalene

5-butylanthra[1,2-g]pteridine-1,3(2H,5H)-dione

5-butylanthra[1,2-g]pteridine-1,3(2H,5H)-dione

Conditions
ConditionsYield
With acetic acid Reflux;46%
violuric acid
87-39-8

violuric acid

tert-butyl (2-((3-(cyclopentyloxy)-4-methylphenyl)amino)ethyl)carbamate
1262317-11-2

tert-butyl (2-((3-(cyclopentyloxy)-4-methylphenyl)amino)ethyl)carbamate

tert-butyl (2-(8-(cyclopentyloxy)-7-methyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)ethyl)carbamate
1262317-12-3

tert-butyl (2-(8-(cyclopentyloxy)-7-methyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)ethyl)carbamate

Conditions
ConditionsYield
In ethanol at 145℃; for 1.5h; Microwave irradiation;38%
benzoimidazole
51-17-2

benzoimidazole

methanol
67-56-1

methanol

violuric acid
87-39-8

violuric acid

cadmium(II) nitrate tetrhydrate

cadmium(II) nitrate tetrhydrate

C30H20Cd2N16O16*2CH4O

C30H20Cd2N16O16*2CH4O

Conditions
ConditionsYield
In water for 3h;37%
pyridine
110-86-1

pyridine

ferrous(II) sulfate heptahydrate

ferrous(II) sulfate heptahydrate

violuric acid
87-39-8

violuric acid

[Fe(violuric acid)3]·pyridine·4H2O

[Fe(violuric acid)3]·pyridine·4H2O

Conditions
ConditionsYield
In methanol for 4h;34%
violuric acid
87-39-8

violuric acid

C24H43N
1416815-95-6

C24H43N

10-hexadecyl-7,8-dimethyl-10H-benzo[g]pteridine-2,4-dione
1416815-96-7

10-hexadecyl-7,8-dimethyl-10H-benzo[g]pteridine-2,4-dione

Conditions
ConditionsYield
With acetic acid for 48h; Reflux; Inert atmosphere; Darkness;30%
violuric acid
87-39-8

violuric acid

1-amino-naphthalene
134-32-7

1-amino-naphthalene

11H-naphtho[2,1-g]pteridine-8,10-dione
196872-59-0

11H-naphtho[2,1-g]pteridine-8,10-dione

Conditions
ConditionsYield
In acetic acid for 24h; Heating;11%
2-thiohydantoin
503-87-7

2-thiohydantoin

violuric acid
87-39-8

violuric acid

5-(5-oxo-2-thioxo-imidazolidin-4-ylidenamino)-barbituric acid

5-(5-oxo-2-thioxo-imidazolidin-4-ylidenamino)-barbituric acid

Conditions
ConditionsYield
With acetic anhydride
2,4,6-triaminopyrimidine
1004-38-2

2,4,6-triaminopyrimidine

violuric acid
87-39-8

violuric acid

6,8-diamino-1H-pyrimido[5,4-g]pteridine-2,4-dione
7147-37-7

6,8-diamino-1H-pyrimido[5,4-g]pteridine-2,4-dione

Conditions
ConditionsYield
With sodium carbonate; acetic acid
4-Amino-2,6-dihydroxypyrimidine
873-83-6

4-Amino-2,6-dihydroxypyrimidine

violuric acid
87-39-8

violuric acid

1,3,6,8-tetrahydro-2,4,5,7-pyrimido<5,4-g>pteridinetetrone
5807-13-6

1,3,6,8-tetrahydro-2,4,5,7-pyrimido<5,4-g>pteridinetetrone

Conditions
ConditionsYield
With hydrogenchloride; acetic acid

87-39-8Relevant articles and documents

Violuric acid and preparation method thereof

-

Paragraph 0055; 0061; 0068; 0075, (2018/09/12)

The invention provides violuric acid and a preparation method thereof. The preparation method comprises the following steps: S1, providing an alkaline water solution of barbituric acid; S2, adding a nitrite water solution into the alkaline water solution of the barbituric acid to form a mixed solution; S3, dropwise adding inorganic acid or an inorganic acid water solution into the mixed solution;carrying out chemical reaction to obtain the violuric acid. According to the preparation method of the violuric acid, provided by the embodiment of the invention, the high-purity violuric acid can beobtained; the method is simple to operate and can be operated at room temperature; the method has high safety and is suitable for industrialized production; meanwhile, raw materials are easy to obtainand the cost is relatively low.

Enol nitrosation revisited: determining reactivity of ambident nucleophiles

Garcia-Rio, Luis,Mejuto, Juan C.,Parajo, Mercedes,Perez-Lorenzo, Moises

supporting information; experimental part, p. 4525 - 4533 (2010/01/16)

Enols are one of the most Important types of ambident nucleophiles being widely used as reagents in organic chemistry, The relevance of enols has led to considerable interest in developing methods to determine the reactivity of their nucleophilic centers, In this sense, the mainstream, literature works on this topic make use of a. combination of overall rate constants together with the analysis of the reaction products, By knowing the product ratio it is possible to determine the ratio between the reaction rates on each site, Thus, the reactivity for each, nucleophilic position can be obtained, This is a reliable approach as long as the isolation or in situ characterization of the reaction products can be carried out, In the case of unstable and/or interconvertible products where the use of identification techniques is not possible, an alternative methodology must be found, For that: reason, our research group has developed a model that allows us to study and quantify separately the reaction rates of enol nucleophilic centers even if only one final reaction product is obtained, This model is based on the fact: that nitrosation of enols shows well-differentiated behavior depending on whether the reaction proceeds through the carbon or the oxygen atom, The present study provides insights into the ambident nature of enols as well as a methodology for determining the chemical reactivity of their nucleophilic centers.

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