Product Name

  • Name

    8-bromo-4-methylquinoline

  • EINECS
  • CAS No. 172939-50-3
  • Density 1.488 g/cm3
  • Solubility
  • Melting Point
  • Formula C10H8BrN
  • Boiling Point 315.773 °C at 760 mmHg
  • Molecular Weight 222.084
  • Flash Point 144.774 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 172939-50-3 (8-bromo-4-methylquinoline)
  • Hazard Symbols
  • Synonyms 8-Bromo-4-methylquinoline;8-Bromo-4-methyl-quinoline;
  • PSA 12.89000
  • LogP 3.30570

Quinoline,8-bromo-4-methyl- Specification

This chemical is called Quinoline,8-bromo-4-methyl-, and it can also be named as 8-Bromo-4-methylquinoline. With the molecular formula of C10H8BrN, its molecular weight is 222.084. The CAS registry number of this chemical is 172939-50-3. In addition, its systematic name is 8-Bromo-4-methyl-quinoline.

Other characteristics of the Quinoline,8-bromo-4-methyl- can be summarised as follows: (1)ACD/LogP: 3.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.201; (4)ACD/LogD (pH 7.4): 3.202; (5)ACD/BCF (pH 5.5): 159.275; (6)ACD/BCF (pH 7.4): 159.763; (7)ACD/KOC (pH 5.5): 1310.756; (8)ACD/KOC (pH 7.4): 1314.776; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.654; (14)Molar Refractivity: 54.702 cm3; (15)Molar Volume: 149.233 cm3 ; (16)Polarizability: 21.685×10-24 cm3; (17)Surface Tension: 48.29 dyne/cm; (18)Density: 1.488 g/cm3; (19)Flash Point: 144.774 °C; (20) Enthalpy of Vaporization: 53.485 kJ/mol; (21)Boiling Point: 315.773 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Cc1ccnc2c1cccc2Br
2.InChI: InChI=1/C10H8BrN/c1-7-5-6-12-10-8(7)3-2-4-9(10)11/h2-6H,1H3
3.InChIKey: RNCFUSVOFDOIRR-UHFFFAOYAB

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