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Substance Name: Mono(2-ethyl-5-hydroxyhexyl) phthalate
RN: 40321-99-1
InChIKey: RYPQSGURZSTFSX-UHFFFAOYSA-N

Note

  • A metabolite of bis(2-ethylhexyl) phthalate.

Molecular Formula

  • C16-H22-O5

Molecular Weight

  • 294.3448
 
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Names and Synonyms

Name of Substance

  • Mono(2-ethyl-5-hydroxyhexyl) phthalate

Synonyms

  • CCRIS 4282
  • Mono(2-ethyl-5-hydroxyhexyl) 1,2-benzenedicarboxylate

Systematic Names

  • 1,2-Benzenedicarboxylic acid, mono(2-ethyl-5-hydroxyhexyl) ester
  • Mono(2-ethyl-5-hydroxyhexyl) phthalate

Registry Numbers

CAS Registry Number

  • 40321-99-1

System Generated Number

  • 0040321991

Structure Descriptors

InChI

1S/C16H22O5/c1-3-12(9-8-11(2)17)10-21-16(20)14-7-5-4-6-13(14)15(18)19/h4-7,11-12,17H,3,8-10H2,1-2H3,(H,18,19)

InChIKey

RYPQSGURZSTFSX-UHFFFAOYSA-N

Smiles

CCC(CCC(C)O)COC(=O)c1ccccc1C(=O)O