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Substance Name: Chloropentafluoroacetone
RN: 79-53-8
InChIKey: OJUUDWYPNQALHZ-UHFFFAOYSA-N

Molecular Formula

  • C3-Cl-F5-O

Molecular Weight

  • 182.475
 
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Names and Synonyms

Results Name

  • Chloropentafluoroacetone

Synonyms

  • 2-Propanone, 1-monochloro-1,1,3,3,3-pentafluoro-
  • 4-01-00-03218 (Beilstein Handbook Reference)
  • Acetone, 1-chloro-1,1,3,3,3-pentafluoro-
  • Acetone, monochloropentafluoro-
  • AI3-52647
  • alpha-Chloroperfluoroacetone
  • BRN 1773589
  • Chloropentafluoro-2-propanone
  • Chloropentafluoroacetone
  • Pentafluorochloroacetone
  • Pentafluoromonochloroacetone

Systematic Name

  • 2-Propanone, 1-chloro-1,1,3,3,3-pentafluoro-

Registry Numbers

CAS Registry Number

  • 79-53-8

System Generated Number

  • 0000079538

Structure Descriptors

InChI

1S/C3ClF5O/c4-2(5,6)1(10)3(7,8)9

InChIKey

OJUUDWYPNQALHZ-UHFFFAOYSA-N

Smiles

C(C(C(F)(F)Cl)=O)(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LC50 inhalation 125ppm/3H (125ppm) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

LUNGS, THORAX, OR RESPIRATION: CHRONIC PULMONARY EDEMA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Toxicology and Applied Pharmacology. Vol. 7, Pg. 592, 1965.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.33E+02 deg C   EXP
Boiling Point 8 deg C   EXP
log P (octanol-water) 0.910 (none)   EST
Water Solubility 8950 mg/L 25 EST
Vapor Pressure 1430 mm Hg 25 EXP
Henry's Law Constant 5.44E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 0.0 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.