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Substance Name: Propane, 1-(1-methylethoxy)-
RN: 627-08-7
InChIKey: JIEJJGMNDWIGBJ-UHFFFAOYSA-N

Molecular Formula

  • C6-H14-O

Molecular Weight

  • 102.176
 
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Names and Synonyms

Synonyms

  • 1-(1-Methylethoxy)propane
  • 4-01-00-01471 (Beilstein Handbook Reference)
  • BRN 1697061
  • Isopropyl propyl ether
  • Propane, 1-(1-methylethoxy)-
  • Propyl isopropyl ether

Systematic Names

  • Ether, isopropyl propyl
  • Propane, 1-(1-methylethoxy)-

Registry Numbers

CAS Registry Number

  • 627-08-7

System Generated Number

  • 0000627087

Structure Descriptors

InChI

1S/C6H14O/c1-4-5-7-6(2)3/h6H,4-5H2,1-3H3

InChIKey

JIEJJGMNDWIGBJ-UHFFFAOYSA-N

Smiles

O(C(C)C)CCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LC50 inhalation 153gm/m3/15M (153000mg/m3) BEHAVIORAL: GENERAL ANESTHETIC Anesthesiology. Vol. 11, Pg. 455, 1950.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 83 deg C   EXP
log P (octanol-water) 1.960 (none)   EST
Water Solubility 4700 mg/L 25 EXP
Vapor Pressure 87.9 mm Hg 25 EST
Henry's Law Constant 2.68E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.26E-11 cm3/molecule-sec 25 EST

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