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Substance Name: Di-2-ethylhexyl azelate
RN: 103-24-2
UNII: 5D67SBH6QB
InChIKey: ZDWGXBPVPXVXMQ-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C25-H48-O4

Molecular Weight

  • 412.65
 
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Names and Synonyms

Name of Substance

  • Di-2-ethylhexyl azelate

Synonyms

  • 3-02-00-01787 (Beilstein Handbook Reference)
  • AI3-07965
  • Azelaic acid, bis(2-ethylhexyl) ester
  • Azelaic acid, di(2-ethylhexyl)ester
  • Bis(2-ethylhexyl) azelate
  • Bis(2-ethylhexyl)azelate
  • Bis-(2-ethylhexyl)ester kyseliny azelaove
  • Bis-(2-ethylhexyl)ester kyseliny azelaove [Czech]
  • BRN 1806182
  • Di(2-ethylhexyl) azelate
  • Di-2-ethylhexyl azelate
  • Dioctyl azelate
  • Dioctyl nonanedioate
  • DOZ
  • EC 203-091-7
  • EINECS 203-091-7
  • Emery 2958
  • Emolien 2986
  • HSDB 2859
  • Nonanedioic acid, bis(2-ethylhexyl) ester
  • Octyl azelate
  • Plastolein 9058
  • Plastolein 9058 DOZ
  • Plastolein 9058DOZ
  • Sansocizer DOZ
  • Staflex DOX
  • Truflex DOX
  • UNII-5D67SBH6QB

Systematic Names

  • Azelaic acid, bis(2-ethylhexyl) ester
  • Bis(2-ethylhexyl) azelate
  • Nonanedioic acid, 1,9-bis(2-ethylhexyl) ester
  • Nonanedioic acid, bis(2-ethylhexyl) ester

Superlist Names

  • Azelaic acid, bis(2-ethylhexyl) ester
  • Bis(2-ethylhexyl) azelate

Registry Numbers

CAS Registry Number

  • 103-24-2

FDA UNII

  • 5D67SBH6QB

Other Registry Number

  • 29058-99-9

System Generated Number

  • 0000103242

Structure Descriptors

InChI

1S/C25H48O4/c1-5-9-16-22(7-3)20-28-24(26)18-14-12-11-13-15-19-25(27)29-21-23(8-4)17-10-6-2/h22-23H,5-21H2,1-4H3

InChIKey

ZDWGXBPVPXVXMQ-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 640mg/kg (640mg/kg)   U.S. Army, Chemical Corps Medical Laboratories Research Reports. Vol. #256, Pg. 1954,
rabbit LD50 skin 20mL/kg (20mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LD50 intravenous 1060mg/kg (1060mg/kg)   U.S. Army, Chemical Corps Medical Laboratories Research Reports. Vol. #256, Pg. 1954,
rat LD50 oral 8720uL/kg (8.72mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -7.80E+01 deg C   EXP
log P (octanol-water) 9.590 (none)   EST
Atmospheric OH Rate Constant 2.96E-11 cm3/molecule-sec 25 EST

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