Product Name

  • Name

    2,6-Difluoro-3-nitrobenzoic acid

  • EINECS
  • CAS No. 83141-10-0
  • Article Data15
  • CAS DataBase
  • Density 1.661 g/cm3
  • Solubility
  • Melting Point 92-96 °C
  • Formula C7H3F2NO4
  • Boiling Point 335.5 °C at 760 mmHg
  • Molecular Weight 203.102
  • Flash Point 156.7 °C
  • Transport Information
  • Appearance solid
  • Safety 26-36/37/39
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 83141-10-0 (2,6-Difluoro-3-nitrobenzoic acid)
  • Hazard Symbols IrritantXi
  • Synonyms 2,6-Difluoro-3-nitrobenzoicacid;NSC 190311;
  • PSA 83.12000
  • LogP 2.09440

2,6-Difluoro-3-nitrobenzoic acid Specification

This chemical is called Benzoic acid, 2,6-difluoro-3-nitro-, and its systematic name is 2,6-difluoro-3-nitrobenzoic acid. With the CAS registry number of 83141-10-0, its product categories are Blocks; Carboxes; FluoroCompounds; NitroCompounds; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Benzene series; Benzoic acid. Additionally, this chemical should be kept cold.

Other characteristics of the Benzoic acid, 2,6-difluoro-3-nitro- can be summarised as followings: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0 ; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 72.12 Å2; (11)Index of Refraction: 1.563; (12)Molar Refractivity: 39.71 cm3; (13)Molar Volume: 122.2 cm3; (14)Polarizability: 15.74×10-24cm3; (15)Surface Tension: 59.2 dyne/cm; (16)Density: 1.661 g/cm3; (17)Flash Point: 156.7 °C; (18)Enthalpy of Vaporization: 61.06 kJ/mol; (19)Boiling Point: 335.5 °C at 760 mmHg; (20)Vapour Pressure: 4.71E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. 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: O=[N+]([O-])c1ccc(F)c(C(=O)O)c1F
2.InChI: InChI=1/C7H3F2NO4/c8-3-1-2-4(10(13)14)6(9)5(3)7(11)12/h1-2H,(H,11,12)
3.InChIKey: PDDHSNODMFIIRV-UHFFFAOYAK

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