Product Name

  • Name

    2-Amino-4-bromophenol

  • EINECS 627-173-0
  • CAS No. 40925-68-6
  • Article Data48
  • CAS DataBase
  • Density 1.768 g/cm3
  • Solubility
  • Melting Point 135-140°C
  • Formula C6H6BrNO
  • Boiling Point 282.8 °C at 760 mmHg
  • Molecular Weight 188.024
  • Flash Point 124.9 °C
  • Transport Information
  • Appearance
  • Safety 26-36/37/39
  • Risk Codes 20/21/22-36/37/38
  • Molecular Structure Molecular Structure of 40925-68-6 (2-Amino-4-bromophenol)
  • Hazard Symbols IrritantXi
  • Synonyms 4-Bromo-2-aminophenol;NSC 523846;2-Amino-4-bromo-phenol;Phenol, 2-amino-4-bromo-;2-Amino-4-brombenzolol;
  • PSA 46.25000
  • LogP 2.31810

2-Amino-4-bromophenol Specification

The 2-Amino-4-bromophenol, with the CAS registry number 40925-68-6, is also known as 2-Amino-4-brombenzolol. The molecular formula of this chemical is C6H6BrNO. It is a kind of yellow flake or needle-like crystal, and belongs to the following product categories: Amines; Phenyls & Phenyl-Het; API intermediates; Phenyls & Phenyl-Het.

The physical properties of 2-Amino-4-bromophenol are as following: (1)ACD/LogP: 1.84; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.677; (8)Molar Refractivity: 40.06 cm3; (9)Molar Volume: 106.3 cm3; (10)Polarizability: 15.88×10-24cm3; (11)Surface Tension: 62.2 dyne/cm; (12)Density: 1.768 g/cm3; (13)Flash Point: 124.9 °C; (14)Enthalpy of Vaporization: 54.27 kJ/mol; (15)Boiling Point: 282.8 °C at 760 mmHg; (16)Vapour Pressure: 0.00192 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin, and it is also harmful by inhalation, in contact with skin and if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(N)c(O)cc1
(2)InChI: InChI=1/C6H6BrNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
(3)InChIKey: JHRIPENGTGSNPJ-UHFFFAOYAG

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