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Substance Name: 1,1'-Ethynylenedicyclohexanol
RN: 78-54-6
UNII: 3AAU8H5L62
InChIKey: YMAIXWWPLZFJLA-UHFFFAOYSA-N

Molecular Formula

  • C14-H22-O2

Molecular Weight

  • 222.326
 
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Names and Synonyms

Name of Substance

  • 1,1'-Ethynylenedicyclohexanol

Synonyms

  • 1,1'-Ethynylenedicyclohexanol
  • 4-06-00-06076 (Beilstein Handbook Reference)
  • AI3-07113
  • Bis(1-hydroxycyclohexyl)acetylene
  • BRN 2101034
  • NSC 4321
  • UNII-3AAU8H5L62

Systematic Names

  • Cyclohexanol, 1,1'-(1,2-ethynediyl)bis- (9CI)
  • Cyclohexanol, 1,1'-ethynylenedi-

Registry Numbers

CAS Registry Number

  • 78-54-6

FDA UNII

  • 3AAU8H5L62

System Generated Number

  • 0000078546

Structure Descriptors

InChI

1S/C14H22O2/c15-13(7-3-1-4-8-13)11-12-14(16)9-5-2-6-10-14/h15-16H,1-10H2

InChIKey

YMAIXWWPLZFJLA-UHFFFAOYSA-N

Smiles

C(#CC1(O)CCCCC1)C1(O)CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05143,