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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 17:35, 16 February 2012 (Saving copy of the {{chembox}} taken from revid 470880965 of page 2C-E for the Chem/Drugbox validation project (updated: 'CASNo').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 17:35, 16 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 470880965 of page 2C-E for the Chem/Drugbox validation project (updated: 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 470880965 of page 2C-E with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name 1-(2,5-Dimethoxy-4-ethylphenyl)-2-aminoethane
Other names 2,5-Dimethoxy-4-ethyl-phenethylamine, Aquarust
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
PubChem CID
InChI
  • InChI=1S/C12H19NO2/c1-4-9-7-12(15-3)10(5-6-13)8-11(9)14-2/h7-8H,4-6,13H2,1-3H3Key: VDRGNAMREYBIHA-UHFFFAOYSA-N
  • InChI=1/C12H19NO2/c1-4-9-7-12(15-3)10(5-6-13)8-11(9)14-2/h7-8H,4-6,13H2,1-3H3Key: VDRGNAMREYBIHA-UHFFFAOYAI
SMILES
  • COc1cc(CC)c(cc1CCN)OC
Properties
Chemical formula C12H19NO2
Molar mass 209.29 g/mol
Solubility in water >70 mg/ml (20 °C)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). ☒N verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound