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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethylbenzene - AR , CAS No.100-41-4
GRADE & PURITY AR ? Analytical Reagent grade — high-purity chemicals meeting strict assay limits for lab analysis. Use when accuracy matters and trace impurities could skew results. Synonyms
AI3-09057 | C07111 | E0064 | EB | ETHYL-BETA,BETA,BETA-D3-BENZENE | FT-0626285 | WLN: 2R | DTXCID10596 | ETHYLBENZENE [IARC] | STL282714 | ETHYLBENZENE (IARC) | ETHYLBENZENE (USP-RS) | Z104473632 | ETHYLBENZENE [USP-RS] | alpha-Methyltoluene | ETHYLBENZEN
Shipped In
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Why this grade AR AR for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.
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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 162 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
AI3-09057 | C07111 | E0064 | EB | ETHYL-BETA,BETA,BETA-D3-BENZENE | FT-0626285 | WLN: 2R | DTXCID10596 | ETHYLBENZENE [IARC] | STL282714 | ETHYLBENZENE (IARC) | ETHYLBENZENE (USP-RS) | Z104473632 | ETHYLBENZENE [USP-RS] | alpha-Methyltoluene | ETHYLBENZEN
Specifications & Purity
AR
Shipped In
FedEx DG Service
Names and Identifiers Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/508811810
Canonical Smiles
CCC1=CC=CC=C1
InChIKey
YNQLUTRBYVCPMQ-UHFFFAOYSA-N
INCHI
1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
Isomeric SMILES
CCC1=CC=CC=C1
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1901871&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Benzene and substituted derivatives Alternative Parents Aromatic hydrocarbons Unsaturated hydrocarbons Molecular Framework Aromatic homomonocyclic compounds Substituents Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene. External Descriptors an aromatic compound Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Not soluble in water, but miscible with most organic solvents such as ethanol and ether. Refractive Index 1.495 Flash Point(°C) 22 °C Boil Point(°C) 136°C Melt Point(°C) -95°C Molecular Weight 106.160 g/mol XLogP3 3.100 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 0 Rotatable Bond Count 1 Exact Mass 106.078 Da Monoisotopic Mass 106.078 Da Topological Polar Surface Area 0.000 Ų Heavy Atom Count 8 Formal Charge 0 Complexity 51.100 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
Documents & Articles Citations of This Product Solution Calculators Molarity Calculator Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator Reviews Need help choosing the grade? Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.
View AR grade guide →
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