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Benzamide, 2,3-difluoro-

  • Name Benzamide, 2,3-difluoro-
  • EINECSN/A
  • CAS No. 18355-75-4
  • Density1.348 g/cm3
  • PSA43.09000
  • LogP1.76400
  • SolubilityN/A
  • Melting Point163-165 °C(lit.)
  • FormulaC7H5F2NO
  • Boiling Point197 °C at 760 mmHg
  • Molecular Weight157.12
  • Flash Point73 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety26-37/39-36/37
  • Risk Codes36/37/38
  • Molecular Structure
    Molecular Structure of 18355-75-4 (2,3-DIFLUOROBENZOIC ACID)
  • Hazard SymbolsIrritantXi
  • SynonymsIrritantXi
  • Article Data3

Benzamide, 2,3-difluoro- Specification

This chemical is called Benzamide, 2,3-difluoro-, and its systematic name is 2,3-difluorobenzamide. With the molecular formula of C7H5F2NO, its molecular weight is 158.10. The CAS registry number of this chemical is 18355-75-4. Additionally, its product categories are Anilines, Amides & Amines; Fluorine Compounds; Organic Building Blocks.

Other characteristics of the Benzamide, 2,3-difluoro- can be summarised as followings: (1)ACD/LogP: 0.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.72; (4)ACD/LogD (pH 7.4): 0.72; (5)ACD/BCF (pH 5.5): 2.07; (6)ACD/BCF (pH 7.4): 2.07; (7)ACD/KOC (pH 5.5): 58.67; (8)ACD/KOC (pH 7.4): 58.67; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.515; (14)Molar Refractivity: 35.17 cm3; (15)Molar Volume: 116.5 cm3; (16)Polarizability: 13.94×10-24cm3; (17)Surface Tension: 41.5 dyne/cm; (18)Density: 1.348 g/cm3; (19)Flash Point: 73 °C; (20)Enthalpy of Vaporization: 43.32 kJ/mol; (21)Boiling Point: 197 °C at 760 mmHg; (22)Vapour Pressure: 0.387 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 if 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: Fc1c(C(=O)N)cccc1F
2.InChI: InChI=1/C7H5F2NO/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H2,10,11)
3.InChIKey: DDAINDMVKSETGF-UHFFFAOYAC

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