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Basic Information
CAS No.: 5392-28-9
Name: Pyrimidinetetramine sulfate
Molecular Structure:
Molecular Structure of 5392-28-9 (Pyrimidinetetramine sulfate)
Formula: C4H10N6O4S
Molecular Weight: 238.227
Synonyms: NSC 248648;Tetraaminopyrimidine sulfate;2,4,5,6-Tetraaminopyrimidine sulfate salt;2,4,5,6-Tetraminopyrimidine sulfate;
EINECS: 226-393-0
Density: 1.648g/cm3
Melting Point: >300 °C(lit.)
Boiling Point: 563.9 °C at 760 mmHg
Flash Point: 329.4 °C
Solubility: slightly soluble in water
Appearance: Light yellow crystal powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 22-24/25-37/39-26-36
PSA: 212.84000
LogP: 1.55820
Synthetic route
63192-57-4

bis(3-hydroxyphenyl)ethane-1,2-dione

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

3-[2,4-diamino-6-(3-hydroxyphenyl)pteridin-7-yl]phenol sulfate

Conditions
ConditionsYield
In 3-methyl-phenol at 50 - 220℃; for 2 - 2.25h;100%
75-15-0

carbon disulfide

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

462066-71-3

2,6-diamino-9H-purine-8-thiol

Conditions
ConditionsYield
With sodium hydrogencarbonate In ethanol for 24h; Heating;97%
70935-14-7

3-hydroxyphenylglyoxal

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

TG100110

Conditions
ConditionsYield
Stage #1: 3-hydroxyphenylglyoxal With hydrogenchloride; acetone oxime at 50℃; for 1h; pH=2 - 3;
Stage #2: 2,4,5,6-tetraaminopyrimidine sulfate for 9h; Heating; Further stages.;
96.5%
70935-14-7

3-hydroxyphenylglyoxal

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

127-06-0

acetone oxime

TG100110

Conditions
ConditionsYield
Stage #1: 3-hydroxyphenylglyoxal; acetone oxime With hydrogenchloride In methanol; water at 50℃; for 1h; pH=~ 2 - ~ 3;
Stage #2: 2,4,5,6-tetraaminopyrimidine sulfate In water at 20℃; for 9h; Heating / reflux;
Stage #3: With water; sodium hydrogencarbonate at 20℃; pH=~ 6 - ~ 7;
96.5%
63192-57-4

bis(3-hydroxyphenyl)ethane-1,2-dione

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

677297-51-7

TG100-115

Conditions
ConditionsYield
With sodium hydrogencarbonate In diethyl ether; water93.3%
79948-21-3

1-butylsulfanylpropan-2-one

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

4215-07-0

2,4-diamino-7-methylpteridine

Conditions
ConditionsYield
With piperidine In water at 20℃; for 268h;93%
5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

383424-15-5

thioacetic acid S-[5-(4-formylphenoxy)pentyl] ester

S-5-{4-[(2,4,6-triamino-N5-pyrimidinylidene)methyl]phenoxy}pentyl thioacetate

Conditions
ConditionsYield
With potassium carbonate In isopropyl alcohol Heating;90%
27318-90-7

1,10-phenanthroline-5,6-dione

5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

928057-09-4

2,4,5,6-tetraaminopyrimidine[3,2-a:2',3'-c]phenazine

Conditions
ConditionsYield
With acetic acid at 130℃; for 3h; Inert atmosphere;87%
Stage #1: 2,4,5,6-tetraaminopyrimidine sulfate With sodium hydroxide In water at 50℃; for 0.666667h;
Stage #2: 1,10-phenanthroline-5,6-dione In ethanol; water for 3h; Reflux;
75%
5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

88297-80-7

1-chloro-1-benzamidoacetone

4215-07-0

2,4-diamino-7-methylpteridine

Conditions
ConditionsYield
With piperidine In water at 20℃; for 168h;86%
5392-28-9

2,4,5,6-tetraaminopyrimidine sulfate

(1Z,4Z,9Z,15Z)-5,10,15,20-Tetrakis-(3,5-di-tert-butyl-phenyl)-porphyrin-2,3-dione

8,11,14,17-tetrakis(3,5-di-tert-butylphenyl)-2,4-diaminopteridino[2,3,b]porphyrin

Conditions
ConditionsYield
In pyridine for 24h; Heating;85%
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    Product name: 2,4,5,6-Tetraaminopyrimidine Sulfate CAS No.:5392-28-9 Molecule Formula:C4H10N6O4S Molecule Weight:238.23 Purity: 98.0% Package: 25kg/drum Description:White or off-white powder Manufacture Standards:Enterprise Standard

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Chemistry

Molecular Formula: C4H10N6O4S
Formula Weight: 238.23
Melting point: >300 °C(lit.)
Flash Point: 329.4 °C  
Boiling Point: 563.9 °C at 760 mmHg
Vapour Pressure: 9.68E-13 mmHg at 25 °C 
Water Solubility: slightly soluble
Appearence: Light yellow crystal powder
Structure of 2,4,5,6-Tetraaminopyrimidine sulfate (CAS NO.5392-28-9):
                         
IUPAC Name: Pyrimidine-2,4,5,6-tetramine ; Sulfuric acid
Canonical SMILES: C1(=C(N=C(N=C1N)N)N)N.OS(=O)(=O)O
InChI: InChI=1S/C4H8N6.H2O4S/c5-1-2(6)9-4(8)10-3(1)7;1-5(2,3)4/h5H2,(H6,6,7,8,9,10);(H2,1,2,3,4)
InChIKey: MQEFDQWUCTUJCP-UHFFFAOYSA-N
Product Category of 2,4,5,6-Tetraaminopyrimidine sulfate (CAS NO.5392-28-9): Amines;(intermediate of methotrexate);Pyrimidines;Heterocyclic Building Blocks

Uses

 2,4,5,6-Tetraaminopyrimidine sulfate (CAS NO.5392-28-9) is used as the intermediate of antineoplastic agent.

Production

 2,4,5,6-Tetraaminopyrimidine sulfate (CAS NO.5392-28-9) can be obtained by nitrosification and reduction of  2,4,6-Triaminopyrimidine .

Safety Profile

Safety: WARNING: Irritates lungs, eyes, skin
Hazard Codes: IrritantXi (Irritant)
Risk Statements: 36/37/38 (Irritating to eyes, respiratory system and skin)
Safety Statements: 22-24/25-37/39-26-36 (Do not breathe dust; Avoid contact with skin and eyes; Wear suitable protective clothing and eye/face protection; In case of contact with eyes, rinse immediately with plenty of water and seek medical advice; Wear suitable protective clothing)
WGK Germany: 3
RTECS: UV9738000

Standards and Recommendations

ASSAY: 98.0% min
RESIDUE ON IGNITION: 0.3% max
MOISTURE: 0.5% max

Specification

 2,4,5,6-Tetraaminopyrimidine sulfate , its cas register number is 5392-28-9. It also can be called Pyrimidine, tetraamino-, sulfate (1:1) ; 2,4,5,6-Pyrimidinetetramine, sulfate (1:1) ; and Pyrimidinetetramine, sulfate (1:1) . 2,4,5,6-Tetraaminopyrimidine sulfate (CAS NO.5392-28-9) should be stored in cool, dry conditions in well sealed containers. It is hazardous, so the first aid measures and others should be known. Such as: When on the skin: first, should flush skin with plenty of water immediately for at least 15 minutes while removing contaminated clothing. Secondly, get medical aid. Or in the eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Then get medical aid soon. While, it's inhaled: Remove from exposure and move to fresh air immediately. Give artificial respiration while not breathing. When breathing is difficult, give oxygen. And as soon as to get medical aid. Then you have the ingesting of the product: Wash mouth out with water, and get medical aid immediately. Notes to physician: Treat supportively and symptomatically.