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Substance Name: 3,7-Dimethyloctanal
RN: 5988-91-0
UNII: F32WFZ5HGW
InChIKey: UCSIFMPORANABL-UHFFFAOYSA-N

Molecular Formula

  • C10-H20-O

Molecular Weight

  • 156.267
 
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Names and Synonyms

Name of Substance

  • 3,7-Dimethyloctanal

Synonyms

  • 3,7-Dimethyloctanal
  • 4-01-00-03371 (Beilstein Handbook Reference)
  • 6,7-Dihydrocitronellal
  • BRN 1721497
  • Dihydrocitronellal
  • EINECS 227-810-9
  • Tetrahydrogeranial
  • UNII-F32WFZ5HGW

Systematic Names

  • 3,7-Dimethyloctanal
  • Octanal, 3,7-dimethyl-

Registry Numbers

CAS Registry Number

  • 5988-91-0

FDA UNII

  • F32WFZ5HGW

Other Registry Number

  • 81738-03-6

System Generated Number

  • 0005988910

Structure Descriptors

InChI

1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h8-10H,4-7H2,1-3H3

InChIKey

UCSIFMPORANABL-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 4400mg/kg (4400mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 119S, 1992.
rat LDLo oral 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 119S, 1992.