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Substance Name: Methyleugenol
RN: 93-15-2
UNII: 29T9VA6R7M
InChIKey: ZYEMGPIYFIJGTP-UHFFFAOYSA-N

Molecular Formula

  • C11-H14-O2

Molecular Weight

  • 178.2296
 

Classification Codes

  • Agricultural Chemical
  • Anesthetics
  • Carcinogens
  • Central Nervous System Agents
  • Central Nervous System Depressants
  • Insect Attractant, Repellent and Chemosterilant
  • Mutagens
  • Mutation Data
  • Noxae
  • Skin / Eye Irritant
  • Tumor Data
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Names and Synonyms

Name of Substance

  • 1,2-Dimethoxy-4-(2-propenyl)benzene
  • Benzene, 1,2-dimethoxy-4-(2-propenyl)-
  • Methyl eugenol
  • Methyleugenol

Synonyms

  • 1,2-Dimethoxy-4-(2-propen-1-yl)benzene
  • 1,2-Dimethoxy-4-(2-propenyl)benzene
  • 1,2-Dimethoxy-4-allylbenzene
  • 1,3,4-Eugenol methyl ether
  • 1-(3,4-Dimethoxyphenyl)-2-propene
  • 1-Allyl-3,4-dimethoxybenzene
  • 3,4-Dimethoxyallylbenzene
  • 4-06-00-06337 (Beilstein Handbook Reference)
  • 4-Allyl-1,2-dimethoxybenzene
  • 4-Allylveratrole
  • AI3-21040
  • Benzene, 1,2-dimethoxy-4-(2-propenyl)-
  • Benzene, 4-allyl-1,2-dimethoxy-
  • BRN 1910871
  • Caswell No. 579AB
  • CCRIS 746
  • EC 202-223-0
  • EINECS 202-223-0
  • ENT 21040
  • EPA Pesticide Chemical Code 203900
  • Eugenyl methyl ether
  • FEMA No. 2475
  • FEMA Number 2475
  • HSDB 4504
  • Methyl eugenol
  • Methyl eugenol ether
  • Methyl eugenyl ether
  • Methyleugenol
  • NSC 209528
  • O-Methyl eugenol
  • O-Methyleugenol
  • UNII-29T9VA6R7M
  • Veratrole methyl ether

Systematic Names

  • 4-Allylveratrole
  • Benzene, 1,2-dimethoxy-4-(2-propen-1-yl)-
  • Benzene, 1,2-dimethoxy-4-(2-propenyl)-
  • Benzene, 4-allyl-1,2-dimethoxy-
  • Methyl eugenol

Superlist Names

  • Eugenyl methyl ether
  • Methyleugenol

Registry Numbers

CAS Registry Number

  • 93-15-2

FDA UNII

  • 29T9VA6R7M

System Generated Number

  • 0000093152

Structure Descriptors

InChI

InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3

InChIKey

ZYEMGPIYFIJGTP-UHFFFAOYSA-N

Smiles

COc1ccc(CC=C)cc1OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 540mg/kg (540mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)		 Archives Internationales de Pharmacodynamie et de Therapie. Vol. 199, Pg. 226, 1972.
mouse LD50 intravenous 112mg/kg (112mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)		 Archives Internationales de Pharmacodynamie et de Therapie. Vol. 199, Pg. 226, 1972.
rabbit LD50 skin > 2025mg/kg (2025mg/kg)   Toxicology and Applied Pharmacology. Vol. 31, Pg. 421, 1975.
rat LC50 inhalation > 4800mg/m3 (4800mg/m3)   Toxicology and Applied Pharmacology. Vol. 31, Pg. 421, 1975.
rat LD50 oral 810mg/kg (810mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 857, 1975.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.00E+00 deg C   EXP
Boiling Point 254.7 deg C   EXP
log P (octanol-water) 3.030 (none)   EST
Water Solubility 500 mg/L 25 EXP
Henry's Law Constant 5.60E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.51E-11 cm3/molecule-sec 25 EST

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