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D136905

Sigma-Aldrich

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:
93-16-3
Molecular Weight:
178.23
EC Number:
202-224-6
MDL number:
MFCD00009282
UNSPSC Code:
12352100
PubChem Substance ID:
329798688
NACRES:
NA.22

description

mixture of isomers

Quality Level

100

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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Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

D136905-5G:
D136905-100G:
D136905-BULK:
D136905-VAR:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCJ3371
MKCD0818
09718TR
09616TQ
11218JG

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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
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
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
Factors influencing conjugation of phenolic compounds with the epsilon-amino group.
Y Takeuchi
The Journal of dermatology, 12(2), 153-160 (1985-04-01)
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