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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-Methylstyrene - ≥97%(GC),stabilized with TBC , CAS No.100-80-1
GRADE & PURITY ≥97%(GC) stabilized with TBC Synonyms
meta-Methylstyrene | DTXCID201436 | CAS-25013-15-4 | DSSTox_GSID_26292 | Tox21_303890 | m-Vinyltoluene | AS-47795 | Vinyl toluene (65-71% m- and 32-35% p-) | FFK4I9430G | HSDB 8450 | 1-Ethenyl-3-methylbenzene | 1-ethenyl-3-methyl-benzene | 1-Methyl-3-ethe
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Why this grade ≥97%(GC),stabilized with TBC for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
meta-Methylstyrene | DTXCID201436 | CAS-25013-15-4 | DSSTox_GSID_26292 | Tox21_303890 | m-Vinyltoluene | AS-47795 | Vinyl toluene (65-71% m- and 32-35% p-) | FFK4I9430G | HSDB 8450 | 1-Ethenyl-3-methylbenzene | 1-ethenyl-3-methyl-benzene | 1-Methyl-3-ethe
Specifications & Purity
≥97%(GC), stabilized with TBC
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504751382 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504751382 Canonical Smiles CC1=CC(=CC=C1)C=C IUPAC Name 1-ethenyl-3-methylbenzene InChIKey JZHGRUMIRATHIU-UHFFFAOYSA-N INCHI 1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h3-7H,1H2,2H3 Isomeric SMILES CC1=CC(=CC=C1)C=C RTECS WL5075800 UN Number 2618 Packing Group III Molecular Weight 118.18 Beilstein 5(4)1367 Reaxy-Rn 1304618 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1304618&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 Styrenes Intermediate Tree Nodes Not available Direct Parent Styrenes Alternative Parents Toluenes Aromatic hydrocarbons Cyclic olefins Molecular Framework Aromatic homomonocyclic compounds Substituents Styrene - Toluene - Aromatic hydrocarbon - Cyclic olefin - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as styrenes. These are organic compounds containing an ethenylbenzene moiety. 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 Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in Methanol, Ether, Benzene, Acetone, Ethanol, Heptane. Soluble in water (0.09 g/L) at 20°C. Sensitivity heat & light sensitive Refractive Index 1.54 Flash Point(°F) 123.8 °F Flash Point(°C) 60°C Boil Point(°C) 169°C Melt Point(°C) -77°C Molecular Weight 118.180 g/mol XLogP3 3.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 0 Rotatable Bond Count 1 Exact Mass 118.078 Da Monoisotopic Mass 118.078 Da Topological Polar Surface Area 0.000 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 94.200 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
Citations of This Product References 1. Qiang Chen, Zhi-Pu Li, Xiao-Qiong Pei, Yan Liu, M. Qaiser Fatmi, Zhong-Liu Wu. (2024) Thermostabilization and molecular dynamics simulation of NaStyA for highly enantioselective (R)-epoxidation of styrene analogues. Molecular Catalysis, [PMID: [10.1016/j.mcat.2024.114312 ]
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