2,6-Dimethylphenol - analytical standard , CAS No.576-26-1

CAS: 576-26-1 Cat. No.: D104340 Peso molecular: 122.17 Beilstein Registry Number: 6485 Número EC: 209-400-1
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GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
J-525163 | NCGC00091680-01 | 2,6-Xylenol, 8CI | NCGC00091680-03 | Vic-m-xylenol | Z104473832 | 2,6-Dimethylphenol,(S) | A806014 | Q-200216 | 2,6-Dimethylphenol 100 microg/mL in Methanol | UNII-I8N0RO87OV | 2,6 Dimethylphenol | 2,6-DIMETHYLPHENOL | 2,6-di-
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D104340-1g
5
25,90US$
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 39 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
J-525163 | NCGC00091680-01 | 2, 6-Xylenol, 8CI | NCGC00091680-03 | Vic-m-xylenol | Z104473832 | 2, 6-Dimethylphenol, (S) | A806014 | Q-200216 | 2, 6-Dimethylphenol 100 microg/mL in Methanol | UNII-I8N0RO87OV | 2, 6 Dimethylphenol | 2, 6-DIMETHYLPHENOL | 2, 6-di-
Especificaciones y pureza
analytical standard
Condiciones de almacenamiento de almacenamiento
Protected from light, Room temperature
Enviado en
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Grado
Analytical standard
Nombres e identificadores
Pubchem Sid504752105
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752105
Sonrisas canónicasCC1=C(C(=CC=C1)C)O
IUPAC Name2,6-dimethylphenol
InChIKeyNXXYKOUNUYWIHA-UHFFFAOYSA-N
INCHI1S/C8H10O/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3
Isómeros SMILES CC1=C(C(=CC=C1)C)O
Número ONU 2261
Grupo de embalaje II
Peso molecular 122.17
Beilstein 6485
Reaxy-Rn 1446677
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1446677&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClasePhenols
SubclassCresols
Intermediate Tree Nodes Not available
Direct ParentOrtho cresols
Alternative Parents m-Xylenes  1-hydroxy-4-unsubstituted benzenoids  Organooxygen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents M-xylene - Xylene - O-cresol - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as ortho cresols. These are organic compounds containing an ortho-cresol moiety, which consists of a benzene bearing one hydroxyl group at ring positions 1 and 2, respectively.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
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Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot NumberCertificate TypeFechaArticulo
G2209121Certificate of AnalysisJan 19, 2026 D104340
L2406235Certificate of AnalysisDec 02, 2024 D104340
E2108260Certificate of AnalysisFeb 09, 2023 D104340
Propiedades químicas y físicas
SolubilidadSoluble in aqueous solutions of hot water, alcohol, ether, chloroform, benzene, and sodium hydroxide.
SensibilidadLight sensitive.
Punto de inflamación (°F)186.8 °F
Punto de inflamación (°C)73℃
Punto de ebullición (°C)203°C
Punto de fusión (°C)43-48℃
Peso molecular122.160 g/mol
XLogP32.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass122.073 Da
Monoisotopic Mass122.073 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count9
Formal Charge0
Complexity80.600
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
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14. Wenyang Fan, Houchun Yan, Huiwen Huang, Yixin Ma, Jun Gao, Dongmei Xu, Yinglong Wang.  (2020)  Measurement and Thermodynamic Modeling of Ternary Liquid–Liquid Equilibrium for Extraction of 2,6-Xylenol from Aromatic Hydrocarbon Mixtures with Different Solvents.  JOURNAL OF CHEMICAL AND ENGINEERING DATA,      [PMID:] [10.1021/acs.jced.0c00718]
15. Yuchao Wu, Mingen Fei, Tingting Chen, Renhui Qiu, Wendi Liu.  (2020)  Biocomposites from bamboo fibers and palm oil-based thermosets: Effects of natural phenolic cross-linkers.  COMPOSITES COMMUNICATIONS,      [PMID:] [10.1016/j.coco.2020.100489]
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17. Xinming Du, Zhe Wang, Hongyu Zhang, Wenchang Liu, Jingmei Xu.  (2020)  Constructing micro-phase separation structure by multi-arm side chains to improve the property of anion exchange membrane.  INTERNATIONAL JOURNAL OF HYDROGEN ENERGY,      [PMID:] [10.1016/j.ijhydene.2020.04.264]
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19. Shifeng Gao, Zhaozheng Song, Fang Lan, Peng Li, Anhe Zhang, Jianju Hu, Qingzhe Jiang.  (2019)  Studies on Physicochemical Properties and Aggregation Behavior of Two Pairs of Betaine Surfactants.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.9b04593]
20. Xue Xiong, Meiling Qi.  (2019)  Adenine-functionalized polypropylene glycol: A novel stationary phase for gas chromatography offering good inertness for acids and bases combined with a unique selectivity.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:31668867] [10.1016/j.chroma.2019.460627]
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