Product Name

  • Name

    6-Bromo-2-methoxyquinoline

  • EINECS
  • CAS No. 99455-05-7
  • Article Data14
  • CAS DataBase
  • Density 1.517 g/cm3
  • Solubility
  • Melting Point 87-89℃
  • Formula C10H8BrNO
  • Boiling Point 312.635 °C at 760 mmHg
  • Molecular Weight 238.084
  • Flash Point 142.877 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 99455-05-7 (6-Bromo-2-methoxyquinoline)
  • Hazard Symbols
  • Synonyms 6-bromo-2-methoxyquinoline;6-Bromo-2-methoxyquinoline 95%;6-Bromo-2-methoxy-1-azanaphthalene;2-methoxy-6-bromoquinoline
  • PSA 22.12000
  • LogP 3.00590

6-Bromo-2-methoxyquinoline Specification

The 6-Bromo-2-methoxyquinoline, with the CAS registry number 99455-05-7, is also known as has the molecular formula C10H8BrNO, besides, its molecular weight is 238.0806. Its systematic name is called 6-bromo-2-methoxyquinoline. 

Physical properties of 6-Bromo-2-methoxyquinoline: (1)ACD/LogP: 3.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 72; (6)ACD/BCF (pH 7.4): 72; (7)ACD/KOC (pH 5.5): 742; (8)ACD/KOC (pH 7.4): 742; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.64; (13)Molar Refractivity: 56.555 cm3; (14)Molar Volume: 156.96 cm3; (15)Surface Tension: 47.665 dyne/cm; (16)Density: 1.517 g/cm3; (17)Flash Point: 142.877 °C; (18)Enthalpy of Vaporization: 53.157 kJ/mol; (19)Boiling Point: 312.635 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc2nc(OC)ccc2c1
(2)InChI: InChI=1/C10H8BrNO/c1-13-10-5-2-7-6-8(11)3-4-9(7)12-10/h2-6H,1H3
(3)InChIKey: KBTKKEMYFUMFSJ-UHFFFAOYAE

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