Product Name

  • Name

    Monochlorophenyl ether

  • EINECS
  • CAS No. 55398-86-2
  • Density 1.1409 (rough estimate)
  • Solubility
  • Melting Point -8oC
  • Formula C12H9 Cl O
  • Boiling Point 293.89°C (rough estimate)
  • Molecular Weight 204.66
  • Flash Point
  • Transport Information
  • Appearance
  • Safety Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−. See also ETHERS and CHLORINATED HYDROCARBONS, ALIPHATIC.
  • Risk Codes
  • Molecular Structure Molecular Structure of 55398-86-2 (Monochlorophenyl ether)
  • Hazard Symbols
  • Synonyms Chlorodiphenylether; Chlorophenyl phenyl ether; Monochlorodiphenyl oxide
  • PSA 9.23000
  • LogP 4.78570

Monochloro diphenyl oxide Chemical Properties

Molecule structure of Monochloro diphenyl oxide (CAS NO.55398-86-2):

IUPAC Name: 1-Chloro-4-phenoxybenzene 
Molecular Weight: 204.65226 g/mol
Molecular Formula: C12H9ClO 
Density: 1.19 g/cm3 
Boiling Point: 283.7 °C at 760 mmHg 
Flash Point: 128.1 °C
Index of Refraction: 1.584
Molar Refractivity: 57.59 cm3
Molar Volume: 171.9 cm3
Polarizability: 22.83×10-24 cm3
Surface Tension: 40.6 dyne/cm 
Enthalpy of Vaporization: 50.17 kJ/mol
Vapour Pressure: 0.00533 mmHg at 25 °C
XLogP3: 4.3
H-Bond Acceptor: 1
Rotatable Bond Count: 2
Exact Mass: 204.034193
MonoIsotopic Mass: 204.034193
Topological Polar Surface Area: 9.2
Heavy Atom Count: 14
Complexity: 158
Canonical SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl
InChI: InChI=1S/C12H9ClO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
InChIKey of Monochloro diphenyl oxide (CAS NO.55398-86-2): PGPNJCAMHOJTEF-UHFFFAOYSA-N

Monochloro diphenyl oxide Toxicity Data With Reference

1.    

orl-gpg LDLo:600 mg/kg

     14CYAT    Industrial Hygiene and Toxicology. 2 (1963),1707.

Monochloro diphenyl oxide Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−. See also ETHERS and CHLORINATED HYDROCARBONS, ALIPHATIC.

Monochloro diphenyl oxide Standards and Recommendations

OSHA PEL: TWA 500 µg/m3

Monochloro diphenyl oxide Specification

 Monochloro diphenyl oxide (CAS NO.55398-86-2) is also named as AI3-01021 ; Monochloro diphenyl ether ; Phenyl ether mono-chloro ; Benzene, chlorophenoxy- ; Ether, monochlorophenyl .

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