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Ethylbenzene

Base Information Edit
  • Chemical Name:Ethylbenzene
  • CAS No.:100-41-4
  • Molecular Formula:C8H10
  • Molecular Weight:106.167
  • Hs Code.:2902600000
  • European Community (EC) Number:202-849-4,616-714-6
  • ICSC Number:0268
  • NSC Number:406903
  • UN Number:1175
  • UNII:L5I45M5G0O
  • DSSTox Substance ID:DTXSID3020596
  • Nikkaji Number:J2.272.471A,J3.192.069H,J3.589K
  • Wikipedia:Ethylbenzene
  • Wikidata:Q409184,Q83038858,Q83048382
  • NCI Thesaurus Code:C173418
  • Metabolomics Workbench ID:50380
  • ChEMBL ID:CHEMBL371561
  • Mol file:100-41-4.mol
Ethylbenzene

Synonyms:ethylbenzene

Suppliers and Price of Ethylbenzene
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
Total 25 raw suppliers
Chemical Property of Ethylbenzene Edit
Chemical Property:
  • Appearance/Colour:colourless liquid 
  • Vapor Pressure:9.21mmHg at 25°C 
  • Melting Point:-95 °C(lit.) 
  • Refractive Index:n20/D 1.495(lit.)  
  • Boiling Point:136.248 °C at 760 mmHg 
  • Flash Point:25.941 °C 
  • PSA:0.00000 
  • Density:0.865 g/cm3 
  • LogP:2.24900 
  • Water Solubility.:0.0206 g/100 mL 
  • XLogP3:3.1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Rotatable Bond Count:1
  • Exact Mass:106.078250319
  • Heavy Atom Count:8
  • Complexity:51.1
  • Transport DOT Label:Flammable Liquid
Purity/Quality:

99% *data from raw suppliers

Safty Information:
  • Pictogram(s): HighlyF+,HarmfulXn,IrritantXi,FlammableF,Toxic
  • Hazard Codes: F:Flammable;
  • Statements: R11:; R20:; 
  • Safety Statements: S16:; S24/25:; S29:; 
MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:
  • Chemical Classes:Solvents -> Aromatic Solvents
  • Canonical SMILES:CCC1=CC=CC=C1
  • Inhalation Risk:A harmful contamination of the air will be reached rather slowly on evaporation of this substance at 20 °C.
  • Effects of Short Term Exposure:The substance is irritating to the eyes, skin and respiratory tract. If this liquid is swallowed, aspiration into the lungs may result in chemical pneumonitis. The substance may cause effects on the central nervous system. Exposure above the OEL could cause lowering of consciousness.
  • Effects of Long Term Exposure:This substance is possibly carcinogenic to humans. The substance may have effects on the kidneys and liver. This may result in impaired functions.
Technology Process of Ethylbenzene

There total 1655 articles about Ethylbenzene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:
Guidance literature:
With n-butyllithium; potassium 2-methylbutan-2-olate; Mechanism; 1) r.t., 17 h, 2) reflux, 7 h; further reagent: D2O;
Guidance literature:
With formic acid; ammonium formate; 5%-palladium/activated carbon; In ethanol; water; at 80 ℃; Product distribution / selectivity;
Guidance literature:
With hydrazine hydrate; C23H40MnNO2P2; potassium tert-butylate; In tert-butyl alcohol; at 115 ℃; for 48h; Green chemistry;
DOI:10.1021/acscatal.7b01729
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