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Merck

W379905

1,2-Dimethoxybenzene

≥99%, FG

Synonym(s):

Pyrocatechol dimethyl ether, Veratrole

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About This Item

Linear Formula:
C6H4(OCH3)2
CAS Number:
91-16-7
Molecular Weight:
138.16
FEMA Number:
3799
Council of Europe no.:
10320
UNSPSC Code:
12164502
PubChem Substance ID:
24901886
Flavis number:
4.062
EC Number:
202-045-3
NACRES:
NA.21
MDL number:
MFCD00008357
Beilstein/REAXYS Number:
1364621
Organoleptic:
anise; clove; spicy; vanilla
Grade:
FG, Fragrance grade, Halal
Biological source:
synthetic
Agency:
follows IFRA guidelines, meets purity specifications of JECFA
Food allergen:
no known allergens

Key Documents

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SMILES string

COc1ccccc1OC

InChI

1S/C8H10O2/c1-9-7-5-3-4-6-8(7)10-2/h3-6H,1-2H3

InChI key

ABDKAPXRBAPSQN-UHFFFAOYSA-N

biological source

synthetic

grade

FG, Fragrance grade, Halal

agency

follows IFRA guidelines, meets purity specifications of JECFA

reg. compliance

EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002

assay

≥99%

refractive index

n20/D 1.533 (lit.)

bp

206-207 °C (lit.)

mp

15 °C (lit.)

density

1.084 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

organoleptic

anise; clove; spicy; vanilla

Quality Level

300, 400

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Related Categories

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H302

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

161.6 °F - closed cup

flash_point_c

72 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
SHBT2415
SHBR6638
SHBN7562
SHBP1825
SHBM6101

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Vincent J Chebny et al.
Organic letters, 11(11), 2253-2256 (2009-05-29)
Definitive X-ray crystallographic evidence is obtained for a single hole (or a polaron) to be uniformly distributed on the three equivalent 1,2-dimethoxybenzenoid (or veratrole) rings in the hexamethoxytriptycene cation radical. This conclusion is further supported by electrochemical analysis and by
Karsten Seidelmann et al.
Journal of insect physiology, 49(12), 1125-1133 (2003-11-20)
Mature gregarious male desert locusts, Schistocerca gregaria, emit the courtship inhibition pheromone phenylacetonitrile. Wings and legs, in particular the fore wings, have been identified as the main releasing sites. Abdomen and head emit only trace amounts of this pheromone. In
John T Yi et al.
The journal of physical chemistry. A, 109(42), 9456-9464 (2006-07-27)
Rotationally resolved S(1) <-- S(0) electronic spectra of 1,2-dimethoxybenzene (DMB) and its water complex have been observed and assigned. The derived values of the rotational constants show that the bare molecule has a planar heavy-atom structure with trans-disposed methoxy groups
P Pärt et al.
Ecotoxicology and environmental safety, 24(3), 275-286 (1992-12-01)
The absorption rates of 4-bromophenol, 2,4-dibromophenol, 3,4,5-trichloroguaiacol, and tetrachloroveratrol across fish gill epithelium have been measured in a perfused gill preparation from rainbow trout (Oncorhynchus mykiss). In additional experiments the absorption rate of tetrachloroveratrol was measured in free swimming fish.
M K Tse et al.
Organic letters, 3(18), 2831-2833 (2001-09-01)
[reaction: see text]. A protocol for performing Rh catalyzed aromatic borylations in cyclohexane has been devised. Borylation at the 5-position of several 1,3-substituted aromatic species ranging from electron-rich (1,3-(NMe(2))(2)C(6)H(4)) to electron-deficient (1,3-(CF(3))(2)C(6)H(4)) yields the corresponding aryl boronate esters. Veratrole was
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