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· · COA & SDS available for every product · Same-day shipping on in-stock items 1,4,5-Trimethylnaphthalene - ≥96%(GC) , CAS No.2131-41-1
Synonyms
D92509 | 1,4,5-TRIMETHYLNAPHTHALENE | 1,4,5-Trimethyl naphthalene | MFCD00216209 | T1711 | CHEBI:89921 | E310186658 | Q27162105 | FT-0634053 | CAA13141 | DTXSID50175575 | 1,4,5-Trimethyl-naphtalene | FSAWRQYDMHSDRN-UHFFFAOYSA-N | EINECS 218-356-2 | Naphth
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Why this grade ≥96%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
D92509 | 1, 4, 5-TRIMETHYLNAPHTHALENE | 1, 4, 5-Trimethyl naphthalene | MFCD00216209 | T1711 | CHEBI:89921 | E310186658 | Q27162105 | FT-0634053 | CAA13141 | DTXSID50175575 | 1, 4, 5-Trimethyl-naphtalene | FSAWRQYDMHSDRN-UHFFFAOYSA-N | EINECS 218-356-2 | Naphth
Specifications & Purity
≥96%(GC)
Names and Identifiers Canonical Smiles CC1=C2C(=CC=C(C2=CC=C1)C)C IUPAC Name 1,4,5-trimethylnaphthalene InChIKey FSAWRQYDMHSDRN-UHFFFAOYSA-N INCHI 1S/C13H14/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h4-8H,1-3H3 Isomeric SMILES CC1=C2C(=CC=C(C2=CC=C1)C)C PubChem CID 16478 Molecular Weight 170.26 Beilstein 5(4)1728 Reaxy-Rn 2042200
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 Naphthalenes Subclass Not available Intermediate Tree Nodes Not available Direct Parent Naphthalenes Alternative Parents Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons Molecular Framework Aromatic homopolycyclic compounds Substituents Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound Description This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings. External Descriptors Not available 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 Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Boil Point(°C) 145°C/12mmHg(lit.) Melt Point(°C) 60 °C Molecular Weight 170.250 g/mol XLogP3 4.900 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 0 Rotatable Bond Count 0 Exact Mass 170.11 Da Monoisotopic Mass 170.11 Da Topological Polar Surface Area 0.000 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 173.000 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
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