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Key Documents

W324906

Sigma-Aldrich

2,6-Xylenol

≥99%, FG

Synonym(s):

2,6-Dimethylphenol, 2-Hydroxy-m-xylene, vic.-m-Xylenol

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About This Item

Linear Formula:
(CH3)2C6H3OH
CAS Number:
Molecular Weight:
122.16
FEMA Number:
3249
Beilstein/REAXYS Number:
1446677
EC Number:
Council of Europe no.:
11261
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
4.042
NACRES:
NA.21

biological source

synthetic

Quality Level

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%

autoignition temp.

1110 °F

bp

203 °C (lit.)

mp

43-45 °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

SMILES string

Cc1cccc(C)c1O

InChI

1S/C8H10O/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3

InChI key

NXXYKOUNUYWIHA-UHFFFAOYSA-N

Gene Information

human ... GABRA1(2554)

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Application


  • Methodological Considerations of the Acetaminophen Detection : This study explores the use of 2,6-Xylenol in the detection of acetaminophen through the indophenol reaction, highlighting its importance in forensic science and toxicology for accurate drug testing (Shinkawa et al., 2023).

  • Carbon Dioxide Solubility in Nonionic Deep Eutectic Solvents Containing Phenolic Alcohols: Investigates the solubility of CO2 in solvents containing 2,6-Xylenol, underscoring its potential in capturing and storing carbon dioxide, which is vital for combating climate change (Alhadid et al., 2022).

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Skin Corr. 1B - STOT SE 3

target_organs

Respiratory system

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk_germany

WGK 3

flash_point_f

186.8 °F - closed cup

flash_point_c

86 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges, type P3 (EN 143) respirator cartridges


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H Yang et al.
Journal of magnetic resonance. Series B, 105(3), 205-210 (1994-11-01)
Modified Jeener solid-echo pulse sequences are proposed for the measurement of the proton dipolar spin-lattice relaxation time, T1D, of motionally restricted (solid-like) components in the presence of mobile molecular species, such as encountered in biological tissue. A phase-cycled composite-pulse sequence
B Mohammadi et al.
European journal of pharmacology, 421(2), 85-91 (2001-06-12)
Propofol directly activates gamma-aminobutyric acid (GABA(A)) receptors in the absence of the natural agonist. This mechanism is supposed to contribute to its sedative-hypnotic actions. We studied the effects of seven structurally related phenol derivatives on chloride inward currents via rat
Pascal Diévart et al.
Physical chemistry chemical physics : PCCP, 8(14), 1714-1723 (2006-04-25)
The uptake of 2,5-dimethylphenol and 2,6-dimethylphenol on aqueous surfaces was measured between 279 and 293 K, using the wetted-wall flow tube technique coupled with UV absorption spectroscopic detection. For both compounds, the uptake coefficients gamma were found to be independent
Gertrud Haeseler et al.
British journal of pharmacology, 145(7), 916-925 (2005-05-25)
Phenol derivatives constitute a family of neuroactive compounds. The aim of our study was to identify structural features that determine their modulatory effects at glycine receptors. We investigated the effects of four methylated phenol derivatives and two halogenated analogues on
Tingting Li et al.
Talanta, 78(4-5), 1497-1502 (2009-04-14)
In the present work, a simple, selective, and sensitive method has been proposed for the determination of four phenols (catechol, resorcinol, 2,6-dimethylphenol, and 2,4,6-trinitrophenol) in water samples. The method is based on poly-(methacrylic acid-co-ethylene glycol dimethacrylate) monolith microextraction (PMME) and

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