Product Name

  • Name

    2-Bromo-N-ethylbenzenesulphonamide

  • EINECS
  • CAS No. 169189-80-4
  • Article Data6
  • CAS DataBase
  • Density 1.529 g/cm3
  • Solubility
  • Melting Point
  • Formula C8H10BrNO2S
  • Boiling Point 353.183 °C at 760 mmHg
  • Molecular Weight 264.143
  • Flash Point 167.4 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes  Xi:;
  • Molecular Structure Molecular Structure of 169189-80-4 (2-Bromo-N-ethylbenzenesulphonamide)
  • Hazard Symbols IrritantXi
  • Synonyms 2-Bromo-N-ethylbenzenesulfonamide;N-Ethyl 2-bromobenzenesulfonamide;
  • PSA 54.55000
  • LogP 3.21900

2-Bromo-N-ethylbenzenesulphonamide Specification

The 2-Bromo-N-ethylbenzenesulphonamide, with the CAS registry number 169189-80-4, is also known as N-Ethyl 2-bromobenzenesulfonamide. It belongs to the product categories of Blocks; Bromides; Sulfonamides. This chemical's molecular formula is C8H10BrNO2S and molecular weight is 264.1395. What's more, its systematic name is 2-Bromo-N-ethylbenzenesulfonamide. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 2-Bromo-N-ethylbenzenesulphonamide are: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 21; (6)ACD/BCF (pH 7.4): 21; (7)ACD/KOC (pH 5.5): 305; (8)ACD/KOC (pH 7.4): 305; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 54.55 Å2; (13)Index of Refraction: 1.564; (14)Molar Refractivity: 56.201 cm3; (15)Molar Volume: 172.719 cm3; (16)Polarizability: 22.28×10-24 cm3; (17)Surface Tension: 43.168 dyne/cm; (18)Density: 1.529 g/cm3; (19)Flash Point: 167.4 °C; (20)Enthalpy of Vaporization: 59.808 kJ/mol; (21)Boiling Point: 353.183 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(NCC)c1ccccc1Br
(2) InChI: InChI=1/C8H10BrNO2S/c1-2-10-13(11,12)8-6-4-3-5-7(8)9/h3-6,10H,2H2,1H3
(3) InChIKey: PAMGXYQVJKXRMX-UHFFFAOYAQ

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