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Substance Name: 2-Heptyl hexanoate
RN: 6624-58-4
UNII: 8KIQ67GW3S
InChIKey: PPQPRIGCIRJGJH-UHFFFAOYSA-N

Molecular Formula

  • C13-H26-O2

Molecular Weight

  • 214.346
 
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Names and Synonyms

Name of Substance

  • 2-Heptyl hexanoate

Synonyms

  • 2-Heptyl hexanoate
  • AI3-06074
  • EINECS 229-582-6
  • UNII-8KIQ67GW3S

Systematic Names

  • 1-Methylhexyl hexanoate
  • Hexanoic acid, 1-methylhexyl ester

Registry Numbers

CAS Registry Number

  • 6624-58-4

FDA UNII

  • 8KIQ67GW3S

System Generated Number

  • 0006624584

Structure Descriptors

InChI

1S/C13H26O2/c1-4-6-8-10-12(3)15-13(14)11-9-7-5-2/h12H,4-11H2,1-3H3

InChIKey

PPQPRIGCIRJGJH-UHFFFAOYSA-N

Smiles

C(=O)(O[C@@H](CCCCC)C)CCCCC