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Substance Name: Perfluoromethylcyclohexane
RN: 355-02-2
UNII: VJ9772YW63
InChIKey: QIROQPWSJUXOJC-UHFFFAOYSA-N

Molecular Formula

  • C7-F14

Molecular Weight

  • 350.049
 
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Names and Synonyms

Name of Substance

  • Perfluoromethylcyclohexane

Synonyms

  • EINECS 206-573-5
  • Flutec PP2
  • NSC 4779
  • Perfluoromethylcyclohexane
  • Tetradecafluoromethylcyclohexane
  • Undecafluoro(trifluoromethyl)cyclohexane
  • UNII-VJ9772YW63

Systematic Names

  • Cyclohexane, 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(trifluoromethyl)-
  • Cyclohexane, 1-trifluoromethyl-1,2,2,3,3,4,4,5,5,6,6-undecafluoro-
  • Cyclohexane, undecafluoro(trifluoromethyl)-
  • Perfluoro(methylcyclohexane)

Registry Numbers

CAS Registry Number

  • 355-02-2

FDA UNII

  • VJ9772YW63

System Generated Number

  • 0000355022

Structure Descriptors

InChI

1S/C7F14/c8-1(7(19,20)21)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12

InChIKey

QIROQPWSJUXOJC-UHFFFAOYSA-N

Smiles

C1(C(C(C(F)(F)C(C1(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LCLo inhalation 825ppm/14H (825ppm)   "Fluorine Chemistry, Volume III. Biological Effects of Organic Fluorides," Simons, J.H., ed., New York, Academic Press, Inc., 1963Vol. 3, Pg. 90, 1963.
rat LD oral > 100mL/kg (100mL/kg)   Personal Communication from Dr. G.F. May, BNFL Fluorochemicals Ltd., Bldg. 619, Springfields, Salwick, Preston, Lancashire PR4 OXJ. UK, Aug. 25, 1995.Vol. 25AUG1995,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.47E+01 deg C   EXP
Boiling Point 76.3 deg C   EXP
log P (octanol-water) 4.040 (none)   EST
Water Solubility 4.670 mg/L 25 EST
Henry's Law Constant 1.08E+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.