6-Amino-4(3H)-quinazolinone
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6-Amino-4(3H)-quinazolinone
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CAS No:
17329-31-6
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Formula:
C8H7N3O
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Chemical Name:
6-Amino-4(3H)-quinazolinone
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Synonyms:
4(3H)-Quinazolinone,6-amino-;4(1H)-Quinazolinone,6-amino-;6-Amino-4(3H)-quinazolinone;6-Amino-4-quinazolinone;6-Amino-4-hydroxyquinazoline;6-Amino-3H-quinazolin-4-one;NSC 338202;6-Amino-4(1H)-quinazolinone;6-Aminoquinazolin-4-ol
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CAS No:
Characteristics
67.5
0.1
1.49±0.1 g/cm3(Predicted)
303 °C @ Solvent: Water
421.1±47.0 °C(Predicted)
247.3±24.0 °C
1.734
2.67E-07mmHg at 25°C
6-Amino-4(3H)-quinazolinone Use and Manufacturing
Intermediate 5 [00201] In a 1 L flask was added Intermediate 5A (1 g, 5.23 mmol) in MeOH(500ml) to give a yellow suspension. 10percent Pd/C (0.056 g, 0.523 mmol) was added. The mixture was stirred at r.t. under a hydrogen balloon for 4 hours. The reaction mixture was filtered and concentrated to a yellow solid 0.84 g (100percent). Intermediate 4; [00201] In a 1 L flask was added Intermediate 4A (1 g, 5.23 mmol) in MeOH(500 mL) to give a yellow suspension. 10percent Pd/C (0.056 g, 0.523 mmol) was added. The mixture was stirred at rt under a hydrogen balloon for 4 h. The reaction mixture was filtered and concentrated to a yellow solid 0.84 g (100percent). General procedure: To a three necked flask, substituted anthranilic acid (1 meq.) was added in excess of formamide (6 meq). The reaction mixture was then heated at 140 °C for 4-6 h. The reaction was monitored with thin layer chromatography and upon completion; ice was added to the reaction mixture. The resultant solid was filtered, washed with water, dissolved in ethyl acetate, dried over MgSOA mixture of 1 g (5 mmol) of 6-nitroquinazolin-4-(3H)-one 11 and 6 g (25 mmol) of SnCl
Computed Properties
Molecular Weight:161.16
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:161.058911855
Monoisotopic Mass:161.058911855
Topological Polar Surface Area:67.5
Heavy Atom Count:12
Complexity:226
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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