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Substance Name: Cyclohexane, 2-propynyl- (9CI)
RN: 17715-00-3
InChIKey: UARFKZSJGDQRLF-UHFFFAOYSA-N

Molecular Formula

  • C9-H14

Molecular Weight

  • 122.21
 
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Names and Synonyms

Synonyms

  • 2-Propynylcyclohexane
  • 3-Cyclohexylpropyne
  • 4-05-00-00419 (Beilstein Handbook Reference)
  • AI3-17859
  • BRN 1849402

Systematic Names

  • Cyclohexane, 2-propynyl- (9CI)
  • Propyne, 3-cyclohexyl-

Registry Numbers

CAS Registry Number

  • 17715-00-3

System Generated Number

  • 0017715003

Structure Descriptors

InChI

1S/C9H14/c1-2-6-9-7-4-3-5-8-9/h1,9H,3-8H2

InChIKey

UARFKZSJGDQRLF-UHFFFAOYSA-N

Smiles

C(#C)CC1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 4, Pg. 232, 1952.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 157.5 deg C   EXP
log P (octanol-water) 4.440 (none)   EST
Atmospheric OH Rate Constant 3.81E-11 cm3/molecule-sec 25 EST

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