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Key Documents

W238503

Sigma-Aldrich

1,3-Dimethoxybenzene

≥98%, FG

Synonym(s):

Dimethylresorcinol, Resorcinol dimethyl ether

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About This Item

Linear Formula:
C6H4(OCH3)2
CAS Number:
Molecular Weight:
138.16
FEMA Number:
2385
Beilstein:
878582
EC Number:
Council of Europe no.:
189
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
4.016
NACRES:
NA.21

biological source

synthetic

Quality Level

grade

FG
Fragrance grade
Halal
Kosher

Agency

follows IFRA guidelines
meets purity specifications of JECFA

reg. compliance

EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117

Assay

≥98%

refractive index

n20/D 1.524 (lit.)

bp

85-87 °C/7 mmHg (lit.)

density

1.055 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

medicinal; chemical; cooling; sweet

SMILES string

COc1cccc(OC)c1

InChI

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

InChI key

DPZNOMCNRMUKPS-UHFFFAOYSA-N

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Related Categories

General description

1,3-Dimethoxybenzene can be used as a flavoring agent in the food industry. It is reported to be found in the volatiles of port wine and Roquefort cheese.

Application


  • Homogeneous Gold Catalysis Using Complexes Recovered from Waste Electronic Equipment.: This research utilizes 1,3-Dimethoxybenzene in catalytic processes involving gold complexes reclaimed from electronic waste, presenting a sustainable approach in catalytic chemistry and highlighting the reuse of precious metals in industrial applications (McCarthy et al., 2022).

  • Sequential Ir/Cu-Mediated Method for the Meta-Selective C-H Radiofluorination of (Hetero)Arenes.: Demonstrates a technique for the meta-selective C-H radiofluorination involving 1,3-Dimethoxybenzene, offering a novel pathway for the synthesis of radio-labelled compounds used in PET imaging, which is crucial for medical diagnostics and research (Wright et al., 2021).

  • Synthesis and antioxidant activities of phenol derivatives from 1,6-bis(dimethoxyphenyl)hexane-1,6-dione.: Discusses the synthesis of new antioxidant compounds derived from 1,3-Dimethoxybenzene, underlining its role in developing therapeutic agents that could mitigate oxidative stress-related diseases (Artunc et al., 2020).

  • One-Step Synthesis of C(2v)-Symmetric Resorcin[4]arene Tetraethers.: This paper details a one-step synthesis method using 1,3-Dimethoxybenzene to create novel macrocyclic molecules, potentially useful in host-guest chemistry and molecular recognition, which are key areas in supramolecular chemistry and nanotechnology (Smith et al., 2020).

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

190.4 °F - closed cup

Flash Point(C)

88 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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1, 3?Dimethoxybenzene, a newly identified component of port wine.
Rogerson FSS, et al.
Journal of the Science of Food and Agriculture, 82(11), 1287-1292 (2002)
Panagiotis Stathopoulos et al.
Journal of peptide science : an official publication of the European Peptide Society, 12(3), 227-232 (2005-08-17)
Decomposition of the resin linkers during TFA cleavage of the peptides in the Fmoc strategy leads to alkylation of sensitive amino acids. The C-terminal amide alkylation, reported for the first time, is shown to be a major problem in peptide
Burdock, GA
Encyclopedia of Food and Color Additives, 1, 839-840 (1997)
Burdock, GA
Encyclopedia of Food and Color Additives, 1, 839-840 (1997)
Martin A Fascione et al.
Carbohydrate research, 348, 6-13 (2011-12-28)
Novel oxathiane spiroketal donors have been synthesised and activated via an umpolung S-arylation strategy using 1,3,5-trimethoxybenzene and 1,3-dimethoxybenzene. The comparative reactivity of the resulting 2,4,6-trimethoxyphenyl (TMP)- and 2,4-dimethoxyphenyl (DMP)-oxathiane spiroketal sulfonium ions is discussed, and their α-stereoselectivity in glycosylation reactions

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