D136905
1,2-Dimethoxy-4-propenylbenzene
99%
Synonym(s):
Isoeugenyl methyl ether
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About This Item
Linear Formula:
CH3CH=CHC6H3(OCH3)2
CAS Number:
Molecular Weight:
178.23
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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description
mixture of isomers
Quality Level
Assay
99%
form
liquid
refractive index
n20/D 1.568 (lit.)
bp
262-264 °C (lit.)
mp
98-100 °C (lit.)
density
1.05 g/mL at 25 °C (lit.)
SMILES string
COc1ccc(\C=C\C)cc1OC
InChI
1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+
InChI key
NNWHUJCUHAELCL-SNAWJCMRSA-N
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Related Categories
Storage Class Code
10 - Combustible liquids
WGK
WGK 2
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
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[In vitro study of the expectorant effect of phenylpropane derivatives of hazelwort. 12. Active substances form Asarum europaeum. L].
L Gracza
Planta medica, 42(2), 155-159 (1981-06-01)
Alexander T Cartus et al.
Drug metabolism and disposition: the biological fate of chemicals, 39(9), 1727-1733 (2011-06-03)
Methylisoeugenol (1,2-dimethoxy-4-propenylbenzene, 1) is a minor constituent of essential oils, naturally occurring as a mixture of cis/trans isomers. 1 is a U.S. Food and Drug Administration-approved food additive and has been given "Generally Recognized as Safe" status. Previously, metabolism of
R Purchase et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 30(6), 475-481 (1992-06-01)
Methyl isoeugenol was administered in rodent diet for a minimum of 28 consecutive days to groups of 16 male and 16 female rats (Sprague-Dawley strain) at levels of approximately 30, 100 and 300 mg/kg body weight/day. A further group of
A call for full ingredient labelling and uniform nomenclature on medicaments.
A E Pink et al.
The British journal of dermatology, 161(2), 489-490 (2009-06-24)
Todd J Barkman
Molecular biology and evolution, 20(2), 168-172 (2003-02-25)
Isoeugenol-O-methyltransferase (IEMT) is an enzyme involved in the production of the floral volatile compounds methyl eugenol and methyl isoeugenol in Clarkia breweri (Onagraceae). IEMT likely evolved by gene duplication from caffeic acid-O-methyltransferase followed by amino acid divergence, leading to the
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