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Substance Name: Perillaldehyde
RN: 2111-75-3
UNII: 6EQL0XA86G
InChIKey: RUMOYJJNUMEFDD-UHFFFAOYSA-N

Note

  • From oil of Perillae herba; has neuropharmacological actions.

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C10-H14-O

Molecular Weight

  • 150.2196
 
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Names and Synonyms

Name of Substance

  • Perillaldehyde

Synonyms

  • 1-Cyclohexene-1-carboxaldehyde, 4-(1-methylethenyl)-
  • 1-Cyclohexene-1-carboxaldehyde, 4-isopropenyl-
  • 4-(1-Methylethenyl)-1-cyclohexene-1-carboxaldehyde
  • 4-Isopropenyl-1-cyclohexene-1-carboxaldehyde
  • CCRIS 9128
  • Dihydrocuminyl aldehyde
  • EINECS 218-302-8
  • FEMA No. 3557
  • NSC 138642
  • P-Mentha-1,8-dien-7-al
  • p-Mentha-1,8-dien-7-al (natural)
  • para-Mentha-1,8-dien-7-al
  • Perilla aldehyde
  • Perillal
  • Perillaldehyde
  • Perillic aldehyde
  • Perillyl aldehyde
  • UNII-6EQL0XA86G

Systematic Names

  • 1-Cyclohexene-1-carboxaldehyde, 4-(1-methylethenyl)-
  • 1-Cyclohexene-1-carboxaldehyde, 4-isopropenyl-
  • 4-Isopropenylcyclohex-1-enecarbaldehyde

Superlist Name

  • Perillaldehyde

Registry Numbers

CAS Registry Number

  • 2111-75-3

FDA UNII

  • 6EQL0XA86G

Other Registry Numbers

  • 1254961-45-9
  • 21090-66-4
  • 6611-91-2

System Generated Number

  • 0002111753

Structure Descriptors

InChI

1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3

InChIKey

RUMOYJJNUMEFDD-UHFFFAOYSA-N

Smiles

C1[C@@H](CC=C(C1)C=O)C(C)=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 799, 1982.
mouse LD50 oral 1720mg/kg (1720mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 799, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point < 25 deg C   EXP
Boiling Point 240 deg C   EXP
log P (octanol-water) 3.340 (none)   EST
Atmospheric OH Rate Constant 1.05E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.