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Substance Name: Ivy carbaldehyde
RN: 27939-60-2
UNII: A5944Q44A4
InChIKey: CYGGTUUCLIFNIU-UHFFFAOYSA-N

Molecular Formula

  • C9-H14-O

Molecular Weight

  • 138.2086
 
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Names and Synonyms

Name of Substance

  • Ivy carbaldehyde

Synonyms

  • 3-Cyclohexene-1-carboxaldehyde, dimethyl-
  • Dimethyl-3-cyclohexene-1-carboxaldehyde
  • EINECS 248-742-6
  • Trivertal
  • UNII-A5944Q44A4

Systematic Names

  • 3-Cyclohexene-1-carboxaldehyde, dimethyl-
  • Dimethylcyclohex-3-ene-1-carbaldehyde

Registry Numbers

CAS Registry Number

  • 27939-60-2

FDA UNII

  • A5944Q44A4

System Generated Number

  • 0027939602

Structure Descriptors

InChI

1S/C9H14O/c1-8-5-3-4-6-9(8,2)7-10/h3,5,7-8H,4,6H2,1-2H3

InChIKey

CYGGTUUCLIFNIU-UHFFFAOYSA-N

Smiles

CC1C=CCCC1(C)C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 29S, 1992.
rat LD50 oral 3600mg/kg (3600mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 29S, 1992.