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89-01-0

Basic Information
CAS No.: 89-01-0
Name: 2,3-Pyrazinedicarboxylic acid
Article Data: 24
Molecular Structure:
Molecular Structure of 89-01-0 (2,3-Pyrazinedicarboxylic acid)
Formula: C6H4N2O4
Molecular Weight: 168.109
Synonyms: 2,3-Dicarboxypyrazine;NSC 1908;
EINECS: 201-875-3
Density: 1.665 g/cm3
Melting Point: 185-188 °C
Boiling Point: 449.1 °C at 760 mmHg
Flash Point: 225.4 °C
Solubility: soluble in water
Appearance: white to pale brown crystalline powder
Hazard Symbols: FlammableF, CorrosiveC
Risk Codes: 36/37/38
Safety: 22-24/25-45-36/37/39-26-16
PSA: 100.38000
LogP: -0.12700
Synthetic route
46150-15-6

pyrazine-2,3-dicarboxylatocopper(II)

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
With water; sodium hydroxide at 90℃; for 2h;73%
91-19-0

2,3-diethynylquinoxaline

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
With potassium permanganate In water at 95℃;71%
With potassium hydroxide; potassium permanganate
With water; permanganate(VII) ion
921-52-8

2,3-Diaminosuccinic acid

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
With sodium hydroxide In methanol 1) 50 deg C, 30 min, 2) relux, 3h;70%
polymer-bound 2,3-pyrazinedicarboxylic acid (19)

polymer-bound 2,3-pyrazinedicarboxylic acid (19)

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
With potassium hydroxide In 1,4-dioxane; water for 48h; Heating;56.3%
13481-25-9

pyrazine-2,3-dicarbonitrile

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
With potassium hydroxide; dihydrogen peroxide40.3%
beim Verseifen;
With sodium peroxide
Multi-step reaction with 2 steps
1: methanol / 20 °C
2: water / Reflux
View Scheme
Multi-step reaction with 5 steps
1: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
2: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
3: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
4: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
5: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
View Scheme
4744-50-7

2,3-pyrazinedicarboxylic anhydride

89-01-0

2,3-dicarboxypyrazine

91-19-0

2,3-diethynylquinoxaline

potassium permanganate

potassium permanganate

alkali

alkali

89-01-0

2,3-dicarboxypyrazine

66505-29-1

3-cyanopyrazine-2-carboxamide

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
2: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
3: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
4: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
View Scheme
70546-26-8

3-cyanopyrazine-2-carboxylic acid

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
2: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
3: K3Na[Mo(CN)4O2]·6H2O / ethanol; water / 39.84 °C / pH 8.5
View Scheme
67367-37-7

3-amidecarbonylpyrazine-2-carboxylic acid

89-01-0

2,3-dicarboxypyrazine

Conditions
ConditionsYield
With K3Na[Mo(CN)4O2]·6H2O In ethanol; water at 39.84℃; pH=8.5;
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    Product Name: 2,3-Pyrazinedicarboxylic acid CAS: 89-01-0 MF: C6H4N2O4 MW: 168.11 EINECS: 201-875-3 Product Categories: Carboxylic Acids;Pyrazines, Pyrimidines & Pyridazines;Pyrazine;Organic acids;Pyrazines;Pyrazinecarboxylic Acid & Der

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Specification

The 2,3-Pyrazinedicarboxylicacid, with the CAS registry number 89-01-0, is also known as Pyrazine-2,3-dicarboxylic acid. It belongs to the product categories of Carboxylic Acids; Pyrazines, Pyrimidines & Pyridazines; Pyrazine; Organic acids; Pyrazines; Pyrazinecarboxylic Acid & Derivatives; Carboxylic Acids; Pyrazines, Pyrimidines & Pyridazines; Heterocycles; Building Blocks;Heterocyclic Building Blocks. Its EINECS registry number is 201-875-3. This chemical's molecular formula is C6H4N2O4 and molecular weight is 168.11. Its IUPAC name is called pyrazine-2,3-dicarboxylic acid. The product can be used as an intermediate of anti-TB drugs pyrazinamide.

Physical properties of 2,3-Pyrazinedicarboxylicacid: (1)ACD/LogP: -3.20; (2)ACD/LogD (pH 5.5): -6.94; (3)ACD/LogD (pH 7.4): -7.34; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 6; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.638; (12)Molar Refractivity: 36.29 cm3; (13)Molar Volume: 100.9 cm3; (14)Surface Tension: 100.7 dyne/cm; (15)Density: 1.665 g/cm3; (16)Flash Point: 225.4 °C; (17)Enthalpy of Vaporization: 74.58 kJ/mol; (18)Boiling Point: 449.1 °C at 760 mmHg; (19)Vapour Pressure: 7.51E-09 mmHg at 25°C.

Preparation: this chemical can be prepared by benzo pyrazine. This reaction will need reagent potassium permanganate and hydrochloric acid. The yield is about 70%.

Uses of 2,3-Pyrazinedicarboxylicacid: it can be used to produce pyrazine-2,3-dicarboxylic acid dimethyl ester. This reaction will need reagent concentrated H2SO4.

When you are using this chemical, please be cautious about it as the following:
This chemical may catch fire in contact with air and only need brief contact with an ignition source which has a very low flash point or evolve highly flammable gases in contact with water. Besides, it may destroy living tissue on contact. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CN=C(C(=N1)C(=O)O)C(=O)O
(2)InChI: InChI=1S/C6H4N2O4/c9-5(10)3-4(6(11)12)8-2-1-7-3/h1-2H,(H,9,10)(H,11,12)
(3)InChIKey: ZUCRGHABDDWQPY-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 7, 1953.