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Substance Name: Dihexyl azelate
RN: 109-31-9
UNII: F3BBD41PQ1
InChIKey: MJOKHGMXPJXFTG-UHFFFAOYSA-N

Molecular Formula

  • C21-H40-O4

Molecular Weight

  • 356.543
 
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Names and Synonyms

Name of Substance

  • Dihexyl azelate

Synonyms

  • Azelaic acid, dihexyl ester
  • Di-n-hexyl azelate
  • Di-n-hexylester kyseliny azelaove
  • Di-n-hexylester kyseliny azelaove [Czech]
  • Dihexyl azelate
  • DnHA
  • EINECS 203-664-1
  • HSDB 5389
  • Nonanedioic acid, dihexyl ester
  • Plastolein 9050
  • Plastolein 9051
  • Plastolein 9051 DHNZ
  • UNII-F3BBD41PQ1

Systematic Names

  • Azelaic acid, dihexyl ester
  • Dihexyl azelate
  • Nonanedioic acid, 1,9-dihexyl ester
  • Nonanedioic acid, dihexyl ester

Registry Numbers

CAS Registry Number

  • 109-31-9

FDA UNII

  • F3BBD41PQ1

System Generated Number

  • 0000109319

Structure Descriptors

InChI

1S/C21H40O4/c1-3-5-7-14-18-24-20(22)16-12-10-9-11-13-17-21(23)25-19-15-8-6-4-2/h3-19H2,1-2H3

InChIKey

MJOKHGMXPJXFTG-UHFFFAOYSA-N

Smiles

C(C(OCCCCCC)=O)CCCCCCC(OCCCCCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 oral > 17mg/kg (17mg/kg)   Toxicology and Applied Pharmacology. Vol. 4, Pg. 247, 1962.
guinea pig LDLo oral 6gm/kg (6000mg/kg)   Toxicology and Applied Pharmacology. Vol. 4, Pg. 247, 1962.
mouse LDLo oral 15gm/kg (15000mg/kg)   "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 226, 1969.
rabbit LD50 skin > 20mL/kg (20mL/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.
rabbit LDLo oral 1gm/kg (1000mg/kg)   "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 226, 1969.
rat LD50 oral 16mL/kg (16mL/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -8.00E+00 deg C   EXP

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