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Substance Name: Hydroxycitronellal
RN: 107-75-5
UNII: 8SQ0VA4YUR
InChIKey: WPFVBOQKRVRMJB-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C10-H20-O2

Molecular Weight

  • 172.266
 
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Names and Synonyms

Name of Substance

  • 7-Hydroxy-3,7-dimethyloctanol
  • Hydroxycitronellal
  • Octanol, 7-hydroxy-3,7-dimethyl-

Synonyms

  • 1-Octanal, 3,7-dimethyl-7-hydroxy-
  • 3,7-Dimethyl-7-hydroxyoctanal
  • 4-01-00-04058 (Beilstein Handbook Reference)
  • 7-Hydroxy-3,7-dimethyloctan-1-al
  • 7-Hydroxy-3,7-dimethyloctanal
  • 7-Hydroxycitronellal
  • AI3-05823
  • BRN 1721290
  • Citronellal hydrate
  • Citronellal, hydroxy-
  • Cyclalia
  • Cyclosia
  • EC 203-518-7
  • EINECS 203-518-7
  • FEMA No. 2583
  • Fixol
  • Hydroxycitronellal
  • Laurine
  • Lilyl aldehyde
  • Muguet synthetic
  • Muguettine principle
  • Musuet synthetic
  • Musuettine principle
  • NSC 406740
  • Octanal, 7-hydroxy-3,7-dimethyl-
  • Oxydihydrocitronellal
  • Phixia
  • UNII-8SQ0VA4YUR

Systematic Names

  • 1-Octanal, 3,7-dimethyl-7-hydroxy-
  • 7-Hydroxy-3,7-dimethyloctanal
  • 7-Hydroxycitronellal
  • Octanal, 7-hydroxy-3,7-dimethyl-

Superlist Names

  • Hydroxycitronellal
  • Octanal, 7-hydroxy-3,7-dimethyl-

Registry Numbers

CAS Registry Number

  • 107-75-5

FDA UNII

  • 8SQ0VA4YUR

Other Registry Number

  • 123238-75-5

System Generated Number

  • 0000107755

Structure Descriptors

InChI

InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3

InChIKey

WPFVBOQKRVRMJB-UHFFFAOYSA-N

Smiles

CC(CCCC(C)(C)O)CC=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 921, 1974.