Product Name

  • Name

    1-(5-CHLORO-2-NITROPHENYL)-1-ETHANONE

  • EINECS
  • CAS No. 18640-60-3
  • Article Data11
  • CAS DataBase
  • Density 1.378 g/cm3
  • Solubility
  • Melting Point 58-61 °C
  • Formula C8H6ClNO3
  • Boiling Point 332.2 °C at 760 mmHg
  • Molecular Weight 199.594
  • Flash Point 154.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes  Xi:;
  • Molecular Structure Molecular Structure of 18640-60-3 (1-(5-CHLORO-2-NITROPHENYL)-1-ETHANONE)
  • Hazard Symbols IrritantXi
  • Synonyms Acetophenone,5'-chloro-2'-nitro- (8CI);1-(5-Chloro-2-nitrophenyl)ethanone;5-Chloro-2-nitroacetophenone;5'-Chloro-2'-nitroacetophenone;NSC 81223;
  • PSA 62.89000
  • LogP 2.97400

Ethanone,1-(5-chloro-2-nitrophenyl)- Specification

The Ethanone,1-(5-chloro-2-nitrophenyl)-, with the CAS registry number 18640-60-3, is also known as 5-Chloro-2-nitroacetophenone. This chemical's molecular formula is C8H6ClNO3 and molecular weight is 199.59. What's more, its systematic name is 1-(5-Ethyl-2-hydroxyphenyl)ethanone. When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin or other mucous membranes.

Physical properties about Ethanone,1-(5-chloro-2-nitrophenyl)-: (1)ACD/LogP: 2.18; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 62.89 Å2; (7)Index of Refraction: 1.573; (8)Molar Refractivity: 47.72 cm3; (9)Molar Volume: 144.7 cm3; (10)Surface Tension: 49.4 dyne/cm; (11)Density: 1.378 g/cm3; (12)Flash Point: 154.7 °C; (13)Enthalpy of Vaporization: 57.5 kJ/mol; (14)Boiling Point: 332.2 °C at 760 mmHg; (15)Vapour Pressure: 0.000148 mmHg at 25°C; (16)Melting point: 58-61 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=[N+]([O-])c1c(cc(Cl)cc1)C(=O)C
(2) InChI: InChI=1/C8H6ClNO3/c1-5(11)7-4-6(9)2-3-8(7)10(12)13/h2-4H,1H3
(3) InChIKey: HVXQVXNQKCPSLH-UHFFFAOYAS

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