Product Name

  • Name

    2-Amino-6-bromobenzonitrile

  • EINECS
  • CAS No. 77326-62-6
  • Article Data6
  • CAS DataBase
  • Density 1.69 g/cm3
  • Solubility
  • Melting Point 152-154℃
  • Formula C7H5BrN2
  • Boiling Point 343.338 °C at 760 mmHg
  • Molecular Weight 197.034
  • Flash Point 161.445 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 77326-62-6 (2-Amino-6-bromobenzonitrile)
  • Hazard Symbols
  • Synonyms 2-AMINO-6-BROMOBENZONITRILE;2-Amino-6-bromobenzonitrile 97%;3-Bromo-2-cyanoaniline
  • PSA 49.81000
  • LogP 2.48418

2-Amino-6-bromobenzonitrile Specification

The CAS register number of 2-Amino-6-bromobenzonitrile is 77326-62-6. The molecular formula about this chemical is C7H5BrN2 and the molecular weight is 197.0341.

Physical properties about 2-Amino-6-bromobenzonitrile are: (1)ACD/LogP: 2.26; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 37; (5)ACD/BCF (pH 7.4): 37; (6)ACD/KOC (pH 5.5): 462; (7)ACD/KOC (pH 7.4): 462; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 49.81 Å2; (12)Index of Refraction: 1.652; (13)Molar Refractivity: 42.659 cm3; (14)Molar Volume: 116.611 cm3; (15)Polarizability: 16.911x10-24cm3; (16)Surface Tension: 65.73 dyne/cm; (17)Density: 1.69 g/cm3; (18)Flash Point: 161.445 °C; (19)Enthalpy of Vaporization: 58.719 kJ/mol; (20)Boiling Point: 343.338 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1c(cccc1Br)N
(2)InChI: InChI=1/C7H5BrN2/c8-6-2-1-3-7(10)5(6)4-9/h1-3H,10H2
(3)InChIKey: ZKZYTSGUONPOPF-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C7H5BrN2/c8-6-2-1-3-7(10)5(6)4-9/h1-3H,10H2
(5)Std. InChIKey: ZKZYTSGUONPOPF-UHFFFAOYSA-N

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