Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Dicaprylyl ether
RN: 629-82-3
UNII: 77JZM5516Z
InChIKey: NKJOXAZJBOMXID-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H34-O

Molecular Weight

  • 242.444
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 1,1'-Oxybisoctane
  • Dicaprylyl ether
  • n-Dioctyl ether
  • Octane, 1,1'-oxybis-,

Synonyms

  • 1,1'-Oxybisoctane
  • 4-01-00-01760 (Beilstein Handbook Reference)
  • AI3-09528
  • Antar
  • BRN 1748226
  • Caprylic ether
  • Di-n-octyl ether
  • Dioctyl ether
  • EC 211-112-6
  • EINECS 211-112-6
  • Ether, di-n-octyl-
  • n-Octyl ether
  • NSC 28948
  • UNII-77JZM5516Z

Systematic Names

  • Dioctyl ether
  • Octane, 1,1'-oxybis-
  • Octyl ether

Registry Numbers

CAS Registry Number

  • 629-82-3

FDA UNII

  • 77JZM5516Z

Other Registry Number

  • 1166299-58-6

System Generated Number

  • 0000629823

Structure Descriptors

InChI

1S/C16H34O/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-16H2,1-2H3

InChIKey

NKJOXAZJBOMXID-UHFFFAOYSA-N

Smiles

O(CCCCCCCC)CCCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1183mg/kg (1183mg/kg)   Journal of Pharmaceutical Sciences. Vol. 67, Pg. 566, 1978.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -7.60E+00 deg C   EXP
Boiling Point 283 deg C   EXP
log P (octanol-water) 6.940 (none)   EST
Atmospheric OH Rate Constant 3.60E-11 cm3/molecule-sec 25 EST

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