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Substance Name: Didecyl 4,5-epoxycyclohexane-1,2-dicarboxylate
RN: 3775-95-9
UNII: J92EW480IY
InChIKey: DVLBHXHZAWSIBU-TXFWVUOCSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C28-H50-O5

Molecular Weight

  • 466.698
 
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Names and Synonyms

Name of Substance

  • Didecyl 4,5-epoxycyclohexane-1,2-dicarboxylate

Synonyms

  • 7-Oxabicyclo(4.1.0)heptane-3,4-dicarboxylic acid, didecyl ester
  • Didecyl 4,5-epoxycyclohexane-1,2-dicarboxylate
  • Didecyl 4,5-epoxyhexahydro-1,2-phthalate
  • UNII-J92EW480IY

Systematic Name

  • 4,5-Epoxycyclohexane-1,2-dicarboxylic acid, di(decyl) ester (mixed isomers)

Registry Numbers

CAS Registry Number

  • 3775-95-9

FDA UNII

  • J92EW480IY

System Generated Number

  • 0003775959

Structure Descriptors

InChI

1S/C28H50O5/c1-3-5-7-9-11-13-15-17-19-31-27(29)23-21-25-26(33-25)22-24(23)28(30)32-20-18-16-14-12-10-8-6-4-2/h23-26H,3-22H2,1-2H3/t23?,24?,25-,26+

InChIKey

DVLBHXHZAWSIBU-TXFWVUOCSA-N

Smiles

CCCCCCCCCCOC(=O)C1C[C@@H]2O[C@@H]2CC1C(=O)OCCCCCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 20mL/kg (20mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LD50 oral > 64mL/kg (64mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.