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Substance Name: Methyl 2-ethylhexanoate
RN: 816-19-3
UNII: 3100891M19
InChIKey: KICUISADAVMYCJ-UHFFFAOYSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C9-H18-O2

Molecular Weight

  • 158.239
 
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Names and Synonyms

Name of Substance

  • Methyl 2-ethylhexanoate

Synonyms

  • AI3-33653
  • EC 212-429-2
  • EINECS 212-429-2
  • UNII-3100891M19

Systematic Names

  • Hexanoic acid, 2-ethyl-, methyl ester
  • Methyl 2-ethylhexanoate

Registry Numbers

CAS Registry Number

  • 816-19-3

FDA UNII

  • 3100891M19

Other Registry Number

  • 125803-33-0

System Generated Number

  • 0000816193

Structure Descriptors

InChI

1S/C9H18O2/c1-4-6-7-8(5-2)9(10)11-3/h8H,4-7H2,1-3H3

InChIKey

KICUISADAVMYCJ-UHFFFAOYSA-N

Smiles

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