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Substance Name: Cyclohexane, diethyl- (mixed isomers)
RN: 1331-43-7
InChIKey: SMAKEJNOUFLEEJ-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C10-H20

Molecular Weight

  • 140.268
 
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Names and Synonyms

Synonyms

  • Cyclohexane, diethyl-
  • Diethylcyclohexane
  • Diethylcyclohexane (mixed isomers)

Systematic Names

  • Cyclohexane, diethyl-
  • Cyclohexane, diethyl- (mixed isomers)

Superlist Names

  • Cyclohexane, diethyl-
  • Diethylcyclohexane

Registry Numbers

CAS Registry Number

  • 1331-43-7

System Generated Number

  • 0001331437

Structure Descriptors

InChI

1S/C10H20/c1-3-9-5-7-10(4-2)8-6-9/h9-10H,3-8H2,1-2H3

InChIKey

SMAKEJNOUFLEEJ-UHFFFAOYSA-N

Smiles

C1(CCC(CC)CC1)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 2500uL/kg (2.5mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LCLo inhalation 2000ppm/4H (2000ppm)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LD50 oral 64mL/kg (64mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 5.030 (none)   EST
Water Solubility 1.230 mg/L 25 EST
Vapor Pressure 2.900 mm Hg 25 EST
Henry's Law Constant 0.792 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.70E-12 cm3/molecule-sec 25 EST

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