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Substance Name: Geranyl acetoacetate
RN: 10032-00-5
UNII: 08QN2PN8MT
InChIKey: RYILZWKGLGVPOC-XYOKQWHBSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C14-H22-O3

Molecular Weight

  • 238.3248
 
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Names and Synonyms

Name of Substance

  • Geranyl acetoacetate

Synonyms

  • 3,7-Dimethyl-2,6-octadien-1-yl 3-oxobutanoate, trans-
  • 3,7-Dimethyl-2,6-octadien-1-yl acetoacetate, trans-
  • 3,7-Dimethyl-2,6-octadienyl 3-oxobutanoate, (E)-
  • 3,7-Dimethyl-2,6-octadienyl acetoacetate, (E)-
  • Acetoacetic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-
  • AI3-04974
  • Butanoic acid, 3-oxo-, 3,7-dimethyl-2,6-octadienyl ester, (E)-
  • EINECS 233-101-5
  • FEMA No. 2510
  • Geranyl 3-oxobutanoate
  • Geranyl acetoacetate
  • Geranyl beta-ketobutyrate
  • UNII-08QN2PN8MT

Systematic Names

  • (E)-3,7-Dimethyl-2,6-octadienyl acetoacetate
  • Acetoacetic acid, 3,7-dimethyl-2,6-octadienyl ester
  • Butanoic acid, 3-oxo-, 3,7-dimethyl-2,6-octadienyl ester, (E)- (9CI)

Superlist Name

  • Geranyl acetoacetate

Registry Numbers

CAS Registry Number

  • 10032-00-5

FDA UNII

  • 08QN2PN8MT

System Generated Number

  • 0010032005

Structure Descriptors

InChI

1S/C14H22O3/c1-11(2)6-5-7-12(3)8-9-17-14(16)10-13(4)15/h6,8H,5,7,9-10H2,1-4H3/b12-8+

InChIKey

RYILZWKGLGVPOC-XYOKQWHBSA-N

Smiles

CC(=CCC/C(=C/COC(=O)CC(=O)C)/C)C