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Substance Name: Bis(2-ethylhexyl) sebacate
RN: 122-62-3
UNII: U9LS47Q72Q
InChIKey: VJHINFRRDQUWOJ-UHFFFAOYSA-N

Molecular Formula

  • C26-H50-O4

Molecular Weight

  • 426.677
 
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Names and Synonyms

Name of Substance

  • Bis(2-ethylhexyl) sebacate
  • Bis(2-ethylhexyl)decanedioate
  • Decanedioic acid, bis(2-ethylhexyl) ester
  • Di-2-ethylhexyl sebacate

Synonyms

  • 1-Hexanol, 2-ethyl-, sebacate
  • 2-Ethylhexyl sebacate
  • 4-02-00-02083 (Beilstein Handbook Reference)
  • AI3-09124
  • Bis(2-ethylhexyl) decanedioate
  • Bis(2-ethylhexyl) sebacate
  • Bis(2-ethylhexyl)sebacate
  • Bis-(2-ethylhexyl)ester kyseliny sebakove
  • Bis-(2-ethylhexyl)ester kyseliny sebakove [Czech]
  • Bisoflex
  • Bisoflex DOS
  • BRN 1806504
  • CCRIS 6191
  • Decanedioic acid, bis(2-ethylhexyl) ester
  • Di(2-ethylhexyl) sebacate
  • Di(2-ethylhexyl)sebacate
  • Diethylhexyl sebacate
  • Dioctyl sebacate
  • Dioctyl sebacate (VAN)
  • DOS
  • EC 204-558-8
  • Edenol 888
  • Edenor DEHS
  • EINECS 204-558-8
  • Ergoplast SDO
  • HSDB 2898
  • Monoplex DOS
  • NSC 68878
  • Octoil S
  • Plexol
  • Plexol 201J
  • PX 438
  • Reolube DOS
  • Reomol DDS
  • Sansocizer DOS
  • Sebacic acid bis(2-ethylhexyl) ester
  • Sebacic acid, di-2-ethylhexyl diester
  • Staflex DOS
  • Uniflex DOS
  • UNII-U9LS47Q72Q

Systematic Names

  • Bis(2-ethylhexyl) sebacate
  • Decanedioic acid, 1,10-bis(2-ethylhexyl) ester
  • Decanedioic acid, bis(2-ethylhexyl) ester
  • Di(2-ethylhexyl) sebacate
  • Sebacic acid, bis(2-ethylhexyl) ester (8CI)
  • Sebacic acid, bis(2-ethylhexyl)ester

Superlist Name

  • Sebacic acid, bis(2-ethylhexyl) ester

Registry Numbers

CAS Registry Number

  • 122-62-3

FDA UNII

  • U9LS47Q72Q

Other Registry Numbers

  • 131170-17-7
  • 28986-40-5

System Generated Number

  • 0000122623

Structure Descriptors

InChI

1S/C26H50O4/c1-5-9-17-23(7-3)21-29-25(27)19-15-13-11-12-14-16-20-26(28)30-22-24(8-4)18-10-6-2/h23-24H,5-22H2,1-4H3

InChIKey

VJHINFRRDQUWOJ-UHFFFAOYSA-N

Smiles

C([C@@H](CCCC)CC)OC(CCCCCCCCC(OC[C@@H](CCCC)CC)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 9500mg/kg (9500mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 62, 1982.
rabbit LD50 intravenous 540mg/kg (540mg/kg)   U.S. Army, Chemical Corps Medical Laboratories Research Reports. Vol. #256, Pg. 1954,
rat LD50 intravenous 900mg/kg (900mg/kg)   U.S. Army, Chemical Corps Medical Laboratories Research Reports. Vol. #256, Pg. 1954,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.80E+01 deg C   EXP
log P (octanol-water) 10.08 (none)   EST
Water Solubility 3.50E-04 mg/L 25 EST
Vapor Pressure 1.00E-07 mm Hg 25 EST
Henry's Law Constant 1.60E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.10E-11 cm3/molecule-sec 25 EST

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