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Murexide

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Name

Murexide

EINECS 221-266-6
CAS No. 3051-09-0 Density 1.5756 (rough estimate)
PSA 176.82000 LogP -1.81120
Solubility slightly soluble in water Melting Point 300 °C
Formula C8H8O6N6 Boiling Point 480.8 °C at 760 mmHg
Molecular Weight 284.188 Flash Point 244.6 °C
Transport Information N/A Appearance Bordeaux powder
Safety 24/25-22-36/37 Risk Codes 22-40
Molecular Structure Molecular Structure of 3051-09-0 (Murexide) Hazard Symbols HarmfulXn
Synonyms

Murexide (6CI);ammonium purpurate;MX;Ammonium purpurate;Ammonium salt purpuric acid;2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-((hexahydro-2,4,6-;Ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-;Barbituric acid, 5,5'-nitrilodi-, monoammonium salt (VAN);

Article Data 21

Murexide Synthetic route

5-hydroxy-2,4,6-trioxo-hexahydro-pyrimidine-5-sulfonic acid ; compound with dimethylamine

A

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

B

124-40-3

dimethyl amine

Conditions
ConditionsYield
at 120℃;
7647-01-0

hydrogenchloride

61066-33-9, 61066-34-0, 61066-35-1, 61127-23-9

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

13556-70-2

N-(4-methylphenyl)-5-methyl-1,2-phenylenediamine

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

61066-33-9, 61066-34-0, 61066-35-1, 61127-23-9

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

29458-44-4

5-methylamino-pyrimidine-2,4,6-trione

ammonium hydroxide

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

64-17-5

ethanol

7664-41-7

ammonia

76-24-4

Alloxantin

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

61066-33-9, 61066-34-0, 61066-35-1, 61127-23-9

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

7664-41-7

ammonia

76-24-4

Alloxantin

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

61066-33-9, 61066-34-0, 61066-35-1, 61127-23-9

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

7664-41-7

ammonia

118-78-5

uramil

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

76-24-4

Alloxantin

absolute alcoholic. ammonia

absolute alcoholic. ammonia

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

Conditions
ConditionsYield
at 100℃;

ammonium hydroxide

118-78-5

uramil

air

air

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

118-78-5

uramil

alkaline hypochlorite solution

alkaline hypochlorite solution

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

631-61-8

ammonium acetate

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

ammonium carbonate

ammonium carbonate

3051-09-0

ammonium 5-(2,4,6-trioxoperhydropyrimidin-5-ylideneamino)barbiturate

Conditions
ConditionsYield
at 80℃;

Murexide Specification

The Ammonium purpurate, with the CAS registry number 3051-09-0 and EINECS registry number 221-266-6, has the IUPAC name of Ammonium 2,6-dioxo-5-[(2,4,6-trioxo-5-hexahydropyrimidinylidene)amino]-3H-pyrimidin-4-olate. It is also known as Murexide, and it is the ammonium salt of purpuric acid. It is a kind of reddish purple powder in its dry state, and slightly soluble in water. The molecular formula of this chemical is C8H8O6N6.

Preparation of Ammonium purpurate: It can be prepared by heating alloxantin in ammonia gas to 100°C, or by boiling uramil (5-aminobarbituric acid) with mercury oxide.

Uses of Ammonium purpurate: Its color purpurate ranges from yellow in strong acidic pH through reddish-purple in weakly acidic solutions to blue-purple in alkaline solutions. Because of this property, it is used as in analytical chemistry as a complexometric indicator for complexometric titrations, most often of calcium ions, but also for Cu, Ni, Co, Th and rare earth metals. And it is also used as a colorimetric reagent for measurement of calcium and rare earth metals.

You can still convert the following datas into molecular structure:
(1)SMILES: c1(c([nH]c(=O)[nH]c1=O)[O-])\N=C1\C(NC(=O)NC1=O)=O.[NH4+]
(2)InChI: InChI=1/C8H5N5O6.H3N/c14-3-1(4(15)11-7(18)10-3)9-2-5(16)12-8(19)13-6(2)17;/h(H2,10,11,14,15,18)(H3,12,13,16,17,19);1H3 

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