Product Name

  • Name

    2(1H)-Quinoxalinone,3-amino-8-methoxy-(9CI)

  • EINECS
  • CAS No. 659729-78-9
  • Article Data3
  • CAS DataBase
  • Density 1.476 g/cm3
  • Solubility
  • Melting Point
  • Formula C9H9N3O2
  • Boiling Point
  • Molecular Weight 191.189
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 659729-78-9 (2(1H)-Quinoxalinone,3-amino-8-methoxy-(9CI))
  • Hazard Symbols
  • Synonyms 3-amino-8-methoxyquinoxalin-2(1H)-one;
  • PSA 81.00000
  • LogP 1.09510

2(1H)-Quinoxalinone,3-amino-8-methoxy-(9CI) Specification

The 2(1H)-Quinoxalinone,3-amino-8-methoxy-(9CI), with the CAS registry number 659729-78-9, belongs to the product category of Piperidine. This chemical's molecular formula is C9H9N3O2 and molecular weight is 191.1867. Its systematic name is called 3-amino-8-methoxyquinoxalin-2(1H)-one.

Physical properties of 2(1H)-Quinoxalinone,3-amino-8-methoxy-(9CI): (1)ACD/LogP: 0.74; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 27; (5)ACD/KOC (pH 7.4): 15; (6)#H bond acceptors: 5; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.681; (10)Molar Refractivity: 49 cm3; (11)Molar Volume: 129.544 cm3; (12)Surface Tension: 57.191 dyne/cm; (13)Density: 1.476 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1cccc2/N=C(/N)C(=O)Nc12
(2)InChI: InChI=1/C9H9N3O2/c1-14-6-4-2-3-5-7(6)12-9(13)8(10)11-5/h2-4H,1H3,(H2,10,11)(H,12,13)
(3)InChIKey: NAWBWSWMWIAHFG-UHFFFAOYAN

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