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Substance Name: Octyl phenylacetate
RN: 122-45-2
UNII: TDN0NV3W9J
InChIKey: VGYPAVUJUMQTGE-UHFFFAOYSA-N

Molecular Formula

  • C16-H24-O2

Molecular Weight

  • 248.364
 
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Names and Synonyms

Name of Substance

  • Octyl phenylacetate

Synonyms

  • Acetic acid, phenyl-, octyl ester
  • AI3-24153
  • Benzeneacetic acid, octyl ester
  • EINECS 204-545-7
  • FEMA No. 2812
  • Octyl alpha-toluate
  • Octyl benzeneacetate
  • Octyl phenylacetate
  • UNII-TDN0NV3W9J

Systematic Names

  • Benzeneacetic acid, octyl ester
  • Octyl phenylacetate

Superlist Name

  • Octyl phenylacetate

Registry Numbers

CAS Registry Number

  • 122-45-2

FDA UNII

  • TDN0NV3W9J

System Generated Number

  • 0000122452

Structure Descriptors

InChI

1S/C16H24O2/c1-2-3-4-5-6-10-13-18-16(17)14-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3

InChIKey

VGYPAVUJUMQTGE-UHFFFAOYSA-N

Smiles

c1(CC(OCCCCCCCC)=O)ccccc1