Product Name

  • Name

    ALLOXAN MONOHYDRATE

  • EINECS 251-501-8
  • CAS No. 2244-11-3
  • Article Data1
  • CAS DataBase
  • Density 1.681g/cm3
  • Solubility Soluble in water, ethanol, acetone, glacial acetic acid and methanol. Slightly soluble in chloroform, petroleum ether, toluene, ethyl acetate and acetic anhydride. Insoluble in ether.
  • Melting Point 240 °C
  • Formula C4H2N2O4.H2O
  • Boiling Point 374.1 °C at 760 mmHg
  • Molecular Weight 160.086
  • Flash Point 180 °C
  • Transport Information
  • Appearance Off-white to beige-yellowish crystalline powder
  • Safety 36/37
  • Risk Codes 20/21/22
  • Molecular Structure Molecular Structure of 2244-11-3 (ALLOXAN MONOHYDRATE)
  • Hazard Symbols HarmfulXn
  • Synonyms 2,4,5,6(1H,3H)-Pyrimidinetetrone,monohydrate (9CI);
  • PSA 115.73000
  • LogP -2.30910

Synthetic route

N-(2-Ethyl-phenyl)-benzene-1,2-diamine
116138-07-9

N-(2-Ethyl-phenyl)-benzene-1,2-diamine

alloxan monohydrate
2244-11-3

alloxan monohydrate

10-(2-Ethyl-phenyl)-10H-benzo[g]pteridine-2,4-dione
116138-09-1

10-(2-Ethyl-phenyl)-10H-benzo[g]pteridine-2,4-dione

Conditions
ConditionsYield
With boric acid In acetic acid at 60℃; for 0.5h;83.3%
1-(4'-methoxy-biphenyl-4-yl)-ethanone
13021-18-6

1-(4'-methoxy-biphenyl-4-yl)-ethanone

alloxan monohydrate
2244-11-3

alloxan monohydrate

C19H16N2O6
1416355-06-0

C19H16N2O6

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;82%
alloxan monohydrate
2244-11-3

alloxan monohydrate

4-acetyl-4'-(methylthio)<1,1'-biphenyl>
83085-94-3

4-acetyl-4'-(methylthio)<1,1'-biphenyl>

C19H16N2O5S
1416355-08-2

C19H16N2O5S

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;80%
N-(4-acetylphenyl)-4-methoxybenzenesulfonamide

N-(4-acetylphenyl)-4-methoxybenzenesulfonamide

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-methoxybenzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-methoxybenzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;76%
C14H12N2O5S

C14H12N2O5S

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-3-nitrobenzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-3-nitrobenzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;74%
C15H12F3NO3S
1088162-86-0

C15H12F3NO3S

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-(trifluoromethyl) benzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-(trifluoromethyl) benzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;73%
N-(4-acetylphenyl)-4-fluorobenzenesulfonamide
347320-93-8

N-(4-acetylphenyl)-4-fluorobenzenesulfonamide

alloxan monohydrate
2244-11-3

alloxan monohydrate

4-fluoro-N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5 yl)acetyl)phenyl)benzenesulfonamide

4-fluoro-N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5 yl)acetyl)phenyl)benzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;72%
4-(p-toluenesulfonylamino)acetophenone
5317-94-2

4-(p-toluenesulfonylamino)acetophenone

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-methyl benzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-methyl benzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;71%
4-acetyl-4'-methylbiphenyl
5748-38-9

4-acetyl-4'-methylbiphenyl

alloxan monohydrate
2244-11-3

alloxan monohydrate

C19H16N2O5
1416355-03-7

C19H16N2O5

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;69%
1-[4-(trifluoromethoxy)[1,1'-biphenyl]-4-yl-]-1-ethanone
282095-74-3

1-[4-(trifluoromethoxy)[1,1'-biphenyl]-4-yl-]-1-ethanone

alloxan monohydrate
2244-11-3

alloxan monohydrate

C19H13F3N2O6
1416355-07-1

C19H13F3N2O6

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;69%
N-(4-acetylphenyl)-3-methylbenzenesulfonamide

N-(4-acetylphenyl)-3-methylbenzenesulfonamide

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-Hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-3-methylbenzenesulfonamide

N-(4-(2-(5-Hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-3-methylbenzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;68%
N-(4-acetylphenyl)benzenesulfonamide
76883-69-7

N-(4-acetylphenyl)benzenesulfonamide

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)benzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)benzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;67%
N-(4-acetylphenyl)-4-nitrobenzenesulfonamide
5433-86-3

N-(4-acetylphenyl)-4-nitrobenzenesulfonamide

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-nitrobenzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-4-nitrobenzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;67%
4-Acetyl-4'-methylsulfonyl-biphenyl
16734-96-6

4-Acetyl-4'-methylsulfonyl-biphenyl

alloxan monohydrate
2244-11-3

alloxan monohydrate

C19H16N2O7S
1416355-09-3

C19H16N2O7S

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;65%
1-(3'-nitrobiphenyl-4-yl)ethanone
5002-11-9

1-(3'-nitrobiphenyl-4-yl)ethanone

alloxan monohydrate
2244-11-3

alloxan monohydrate

C18H13N3O7
1416355-02-6

C18H13N3O7

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;64%
N-(4-acetylphenyl)-3-fluorobenzenesulfonamide
690961-82-1

N-(4-acetylphenyl)-3-fluorobenzenesulfonamide

alloxan monohydrate
2244-11-3

alloxan monohydrate

3-fluoro-N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)benzenesulfonamide

3-fluoro-N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)benzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;63%
methyl 2-((2-aminophenyl)amino)benzoate
5814-40-4

methyl 2-((2-aminophenyl)amino)benzoate

alloxan monohydrate
2244-11-3

alloxan monohydrate

2-(2,4-Dioxo-3,4-dihydro-2H-benzo[g]pteridin-10-yl)-benzoic acid methyl ester
116138-10-4

2-(2,4-Dioxo-3,4-dihydro-2H-benzo[g]pteridin-10-yl)-benzoic acid methyl ester

Conditions
ConditionsYield
With boric acid In acetic acid at 60℃; for 0.5h;62.5%
alloxan monohydrate
2244-11-3

alloxan monohydrate

4-(N,N-dimethylaminocarbonyl)phenylboronic acid
405520-68-5

4-(N,N-dimethylaminocarbonyl)phenylboronic acid

C21H19N3O6
1416355-12-8

C21H19N3O6

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;62%
alloxan monohydrate
2244-11-3

alloxan monohydrate

1-(4'-(hydroxymethyl)-[1,1'-biphenyl]-4-yl)ethan-1-one

1-(4'-(hydroxymethyl)-[1,1'-biphenyl]-4-yl)ethan-1-one

C19H16N2O6
1416355-05-9

C19H16N2O6

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;62%
C15H12F3NO3S

C15H12F3NO3S

alloxan monohydrate
2244-11-3

alloxan monohydrate

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-2-(trifluoromethyl) benzenesulfonamide

N-(4-(2-(5-hydroxy-2,4,6-trioxohexahydropyrimidin-5-yl)acetyl)phenyl)-2-(trifluoromethyl) benzenesulfonamide

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h;62%
4'-(4-chlorophenyl)acetophenone
5002-07-3

4'-(4-chlorophenyl)acetophenone

alloxan monohydrate
2244-11-3

alloxan monohydrate

C18H13ClN2O5
1416355-04-8

C18H13ClN2O5

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;60%
alloxan monohydrate
2244-11-3

alloxan monohydrate

2-amino-benzenethiol
137-07-5

2-amino-benzenethiol

Conditions
ConditionsYield
In acetonitrile for 5h; Heating;57%
4,4'-diacetylbiphenyl
787-69-9

4,4'-diacetylbiphenyl

alloxan monohydrate
2244-11-3

alloxan monohydrate

C20H16N2O6
1416355-10-6

C20H16N2O6

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;55%
N1-(biphenyl-2-yl) benzene-1,2-diamine
101908-73-0

N1-(biphenyl-2-yl) benzene-1,2-diamine

alloxan monohydrate
2244-11-3

alloxan monohydrate

10-Biphenyl-2-yl-10H-benzo[g]pteridine-2,4-dione
116138-08-0

10-Biphenyl-2-yl-10H-benzo[g]pteridine-2,4-dione

Conditions
ConditionsYield
With boric acid In acetic acid at 60℃; for 0.5h;54.5%
3-(methylamino)-4-aminoacetophenone
92642-29-0

3-(methylamino)-4-aminoacetophenone

alloxan monohydrate
2244-11-3

alloxan monohydrate

8-acetyl-10-methylisoalloxazine
79127-38-1

8-acetyl-10-methylisoalloxazine

Conditions
ConditionsYield
In hydrogenchloride; ethanol for 0.333333h; Heating;51%
alloxan monohydrate
2244-11-3

alloxan monohydrate

1-(4-(thiophen-3-yl)phenyl)ethan-1-one
172035-84-6

1-(4-(thiophen-3-yl)phenyl)ethan-1-one

C16H12N2O5S
1416355-13-9

C16H12N2O5S

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;49%
1-(4-biphenylyl)-2-propanone
5333-01-7

1-(4-biphenylyl)-2-propanone

alloxan monohydrate
2244-11-3

alloxan monohydrate

A

C19H16N2O5
1416355-14-0

C19H16N2O5

B

C19H16N2O5
1416355-15-1

C19H16N2O5

Conditions
ConditionsYield
With acetic acid at 115℃; for 3h; Reflux;A 27%
B 48%
N-1-dodecyl ortho-phenylenediamine
64241-76-5

N-1-dodecyl ortho-phenylenediamine

alloxan monohydrate
2244-11-3

alloxan monohydrate

10-dodecyl-10H-benzo[g]pteridine-2,4-dione
79828-16-3

10-dodecyl-10H-benzo[g]pteridine-2,4-dione

Conditions
ConditionsYield
With boric acid In methanol at 60℃; for 1h; Yield given;
N-(2-Benzhydrylsulfanyl-ethyl)-benzene-1,2-diamine
1035802-16-4

N-(2-Benzhydrylsulfanyl-ethyl)-benzene-1,2-diamine

alloxan monohydrate
2244-11-3

alloxan monohydrate

10-(2-diphenylmethylthio)ethylisoalloxazine
116385-06-9

10-(2-diphenylmethylthio)ethylisoalloxazine

Conditions
ConditionsYield
With hydrogenchloride; ethanol 110-115 degC, 30 min. then r.t., 24 h; Yield given;
alloxan monohydrate
2244-11-3

alloxan monohydrate

1-(2-Amino-3-methylamino-phenyl)-ethanone

1-(2-Amino-3-methylamino-phenyl)-ethanone

6-acetyl-10-methylisoalloxazine
92642-15-4

6-acetyl-10-methylisoalloxazine

Conditions
ConditionsYield
In hydrogenchloride; ethanol 1.) 50-60 deg C, 70 min; 2.) reflux, 15 min;498 mg

Alloxan monohydrate Chemical Properties

Product Name: Mesoxalylurea monohydrate (CAS NO.2244-11-3)


Molecular Formula: C4H4N2O5
Molecular Weight: 160.08g/mol
Mol File: 2244-11-3.mol
Einecs: 251-501-8
Appearance: Off-white to beige-yellowish crystalline powder
Melting Point: 255 °C (dec.)(lit.)
Boiling point: 374.1 °C at 760 mmHg
Storage Temperature: 2-8°C
Flash Point: 180 °C
Water Solubility: H2O: may be hazy yellow
Sensitive: Air Sensitive
Enthalpy of Vaporization: 69.46 kJ/mol
Vapour Pressure: 8.59E-07 mmHg at 25°C
H-Bond Donor: 3
H-Bond Acceptor: 5
Product Categories: Pyridines, Pyrimidines, Purines and Pteredines; Active Pharmaceutical Ingredients

Alloxan monohydrate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
hamster LD50 intravenous 65400ug/kg (65.4mg/kg) GASTROINTESTINAL: OTHER CHANGES Journal of Pharmacology and Experimental Therapeutics. Vol. 87, Pg. 382, 1946.
mouse LDLo intravenous 100mg/kg (100mg/kg)   Diabetes. Vol. 12, Pg. 66, 1963.
pig LDLo intravenous 200mg/kg (200mg/kg) ENDOCRINE: DIABETES MELLITIS

ENDOCRINE: HYPERGLYCEMIA
Metabolism, Clinical and Experimental. Vol. 29, Pg. 40, 1980.

Alloxan monohydrate Safety Profile

Poison by intravenous route. An experimental teratogen. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Safety Information of Mesoxalylurea monohydrate (CAS NO.2244-11-3):
Hazard Codes: Xn,Xi
Risk Statements: 20/21/22-36/37/38
20:  Harmful by inhalation 
21:  Harmful in contact with skin 
22:  Harmful if swallowed 
36:  Irritating to the eyes 
37:  Irritating to the respiratory system 
38:  Irritating to the skin  
Safety Statements: 36-26-36/37
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:  Wear suitable protective clothing  
37:  Wear suitable gloves 

Alloxan monohydrate Specification

 Mesoxalylurea monohydrate ,its CAS NO. is 2244-11-3,the synonyms is 2,4,5,6(1H,3h)-pyrimidinetetronehydrate ; 2,4,5,6-Tetraoxohexahydropyrimidinehydrate ; Mesoxalylcarbamidemonohydrate ; Labotest-bb lt00138148 ; Mesoxalylurea ; Mesoxalylurea, monohydrate ; 2,4,5,6-Tetraoxypyrimidine ; 2,4,5,6-Tetraoxypyrimidine monohydrate .

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