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Substance Name: alpha-Amylcinnamaldehyde diethyl acetal
RN: 60763-41-9
UNII: 3FMP5Z2ZYW
InChIKey: MPKOLWUWOADQCX-UHFFFAOYSA-N

Molecular Formulas

  • C18-H20-O2
  • C18-H28-O2

Molecular Weight

  • 276.417
 
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Names and Synonyms

Name of Substance

  • alpha-Amylcinnamaldehyde diethyl acetal

Synonyms

  • (2-(Diethoxymethyl)-1-heptenyl)benzene
  • 1,1-Diethoxy-2-(phenylmethylene) heptane
  • 1,1-Diethoxy-2-amyl-3-phenyl-2-propene
  • 1,1-Diethoxy-2-n-amyl-3-phenylacrolein
  • alpha-Amylcinnamaldehyde diethyl acetal
  • alpha-Amylcinnamaldehyde, diethyl acetal
  • alpha-Amylcinnamic aldehyde diethyl acetal
  • Amyl cinnamic aldehyde diethyl acetal
  • EINECS 262-413-4
  • UNII-3FMP5Z2ZYW

Systematic Names

  • 2-Diethoxymethyl-1-phenylhept-1-ene
  • Benzene, (2-(diethoxymethyl)-1-hepten-1-yl)-
  • Benzene, (2-(diethoxymethyl)-1-heptenyl)-
  • Heptane, 1,1-diethoxy-2-(phenylmethylene)-

Registry Numbers

CAS Registry Number

  • 60763-41-9

FDA UNII

  • 3FMP5Z2ZYW

System Generated Number

  • 0060763419

Structure Descriptors

InChI

InChI=1S/C18H28O2/c1-4-7-9-14-17(18(19-5-2)20-6-3)15-16-12-10-8-11-13-16/h8,10-13,15,18H,4-7,9,14H2,1-3H3

InChIKey

MPKOLWUWOADQCX-UHFFFAOYSA-N

Smiles

CCCCC\C(=C\c1ccccc1)\C(OCC)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 11, Pg. 857, 1973.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 11, Pg. 857, 1973.