Misplaced Pages

:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox: Difference between revisions - Misplaced Pages

Article snapshot taken from Wikipedia with creative commons attribution-sharealike license. Give it a read and then ask your questions in the chat. We can research this topic together.
< Misplaced Pages:WikiProject Chemicals | Chembox validation Browse history interactively← Previous editNext edit →Content deleted Content addedVisualWikitext
Revision as of 11:29, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 477076563 of page Ethanol for the Chem/Drugbox validation project (updated: '').← Previous edit Revision as of 11:30, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 477150992 of page Ethylbenzene for the Chem/Drugbox validation project (updated: '').Next edit →
Line 1: Line 1:
{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} {{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}}
{{Chembox {{chembox
| verifiedrevid = 443744682
| Watchedfields = changed
| Name = Ethylbenzene
| verifiedrevid = 407816911
| ImageFileL1 = Ethanol-2D-flat.png | ImageFileL1 = Structural formulas ethylbenzene.svg
| ImageSizeL1 = 80px
| ImageFileL1_Ref = {{chemboximage|correct|??}}
| ImageNameL1 = Skeletal formula
| ImageSizeL1 = 131
| ImageFileR1 = Ethylbenzene-3D-balls.png
| ImageNameL1 = Full structural formula of ethanol
| ImageSizeR1 = 120px
| ImageFileR1 = Ethanol-2D-skeletal.svg
| ImageNameR1 = Ball-and-stick model
| ImageFileR1_Ref = {{chemboximage|correct|??}}
| ImageSizeR1 = 111 | IUPACName = Ethylbenzene
| OtherNames = Ethylbenzol, EB,<br />phenylethane
| ImageNameR1 = Skeletal formula of ethanol
| ImageFileL2 = Ethanol-3D-balls.png
| ImageFileL2_Ref = {{chemboximage|correct|??}}
| ImageSizeL2 = 131
| ImageNameL2 = Ball-and-stick model of ethanol
| ImageFileR2 = Ethanol-3D-vdW.png
| ImageFileR2_Ref = {{chemboximage|correct|??}}
| ImageSizeR2 = 111
| ImageNameR2 = Space-filling model of ethanol
| SystematicName = Ethanol<ref name="Pubchem">{{cite web|title = Ethanol – Compound Summary|url = http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=702|work = The PubChem Project|location = USA|publisher = National Center for Biotechnology Information}}</ref>
| OtherNames = Absolute alcohol<br />
Alcohol <br />
Drinking alcohol<br />
Ethyl alcohol<br />
Ethyl hydrate<br />
Ethyl hydroxide<br />
Ethylic alcohol<br />
Ethylol<br />
Grain alcohol<br />
Hydroxyethane<br />
Methylcarbinol
| Section1 = {{Chembox Identifiers | Section1 = {{Chembox Identifiers
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| CASNo = 64-17-5
| DrugBank = DB01722
| CASNo_Ref = {{cascite|correct|CAS}}
| ChEBI_Ref = {{ebicite|correct|EBI}}
| PubChem = 702
| ChEBI = 16101
| PubChem_Ref = {{Pubchemcite|correct|PubChem}}
| SMILES = CCc1ccccc1
| ChemSpiderID = 682
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| ChemSpiderID = 7219
| UNII = 3K9958V90M
| UNII_Ref = {{fdacite|correct|FDA}} | ChEMBL_Ref = {{ebicite|correct|EBI}}
| EINECS = 200-578-6 | ChEMBL = 371561
| UNII_Ref = {{fdacite|correct|FDA}}
| UNNumber = 1170
| UNII = L5I45M5G0O
| DrugBank_Ref = {{drugbankcite|correct|drugbank}}
| KEGG_Ref = {{keggcite|correct|kegg}}
| DrugBank = DB00898
| KEGG = D00068 | KEGG = C07111
| InChI = 1/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
| KEGG_Ref = {{keggcite|correct|kegg}}
| InChIKey = YNQLUTRBYVCPMQ-UHFFFAOYAM
| MeSHName = Ethanol
| ChEBI_Ref = {{ebicite|correct|EBI}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
| ChEBI = 16236
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| ChEMBL = 545
| StdInChIKey = YNQLUTRBYVCPMQ-UHFFFAOYSA-N
| ChEMBL_Ref = {{ebicite|correct|EBI}}
| CASNo_Ref = {{cascite|correct|CAS}}
| RTECS = KQ6300000
| ATCCode_prefix = D01 | CASNo = 100-41-4
| ATCCode_suffix = AE06 | RTECS = DA0700000
| PubChem = 7500
| ATC_Supplemental = {{ATC|D08|AX08}}, {{ATC|V03|AB16}}, {{ATC|V03|AZ01}}
}}
| Beilstein = 1718733
| Gmelin = 787
| 3DMet = B01253
| SMILES = CCO
| StdInChI = 1S/C2H6O/c1-2-3/h3H,2H2,1H3
| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| InChI = 1/C2H6O/c1-2-3/h3H,2H2,1H3
| StdInChIKey = LFQSCWFLJHTTHZ-UHFFFAOYSA-N
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| InChIKey = LFQSCWFLJHTTHZ-UHFFFAOYAB}}
| Section2 = {{Chembox Properties | Section2 = {{Chembox Properties
| C = 2 | C=8|H=10
| Appearance = Clear, colorless liquid
| H = 6
| O = 1 | Density = 0.8665 g/mL
| Solubility = 0.015 g/100 mL (20 °C)
| ExactMass = 46.041864814 g mol<sup>−1</sup>
| MeltingPtC = -95
| Appearance = Colorless liquid
| BoilingPtC = 136
| Density = 0.789 g/cm<sup>3</sup>
| Viscosity = 0.669 ] at 20 °C
| MeltingPtC = −114
}}
| BoilingPtC = 78
| Section3 = {{Chembox Structure
| LogP = -0.18
| MolShape =
| VaporPressure = 5.95 kPa (at 20 °C)
| Dipole =
| pKa = 15.9<ref>Ballinger, P., Long, F.A., ''J. Am. Chem. Soc.'', '''1960''', ''82'', 795.</ref>
}}
| pKb = -1.9
| Section7 = {{Chembox Hazards
| RefractIndex = 1.36
| ExternalMSDS =
| Viscosity = 0.0012 Pa s (at 20 °C)
| MainHazards = Flammable
| Dipole = 1.69 D
| NFPA-H = 2
}}
| NFPA-F = 3
| Section3 = {{Chembox Pharmacology
| NFPA-R =
| AdminRoutes = Intramuscular<br />
| FlashPt = 15-20 °C
Intravenous<br />
| RPhrases = {{R11}} {{R20}}
Oral<br />
| SPhrases = {{S2}} {{S16}} {{S24/25}} {{S29}}
Topical
}}
| Metabolism = Hepatic
| Section8 = {{Chembox Related
| ] - Low-Moderate
| Function = ]
}}
| OtherFunctn = ], ]
| Section4 = {{Chembox Hazards
| OtherCpds = ]<br />]
| EUIndex = 603-002-00-5
}}
| EUClass = {{Hazchem F}}
| RPhrases = {{R11}}
| SPhrases = {{S2}}, {{S7}}, {{S16}}
| NFPA-H = 2
| NFPA-F = 3
| NFPA-R = 0
| FlashPt = 13–14 °C
| Autoignition = 362 °C
| LD50 = 5628 mg kg<sup>−1</sup> (oral, rat)
}}
}} }}

Revision as of 11:30, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 477150992 of page Ethylbenzene with values updated to verified values.
Ethylbenzene
Skeletal formula
Skeletal formula
Ball-and-stick model
Ball-and-stick model
Names
IUPAC name Ethylbenzene
Other names Ethylbenzol, EB,
phenylethane
Identifiers
CAS Number
3D model (JSmol)
ChEBI
ChEMBL
ChemSpider
DrugBank
KEGG
PubChem CID
RTECS number
  • DA0700000
UNII
InChI
  • InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3Key: YNQLUTRBYVCPMQ-UHFFFAOYSA-N
  • InChI=1/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3Key: YNQLUTRBYVCPMQ-UHFFFAOYAM
SMILES
  • CCc1ccccc1
Properties
Chemical formula C8H10
Molar mass 106.168 g·mol
Appearance Clear, colorless liquid
Density 0.8665 g/mL
Melting point −95 °C (−139 °F; 178 K)
Boiling point 136 °C (277 °F; 409 K)
Solubility in water 0.015 g/100 mL (20 °C)
Viscosity 0.669 cP at 20 °C
Hazards
Occupational safety and health (OHS/OSH):
Main hazards Flammable
NFPA 704 (fire diamond)
NFPA 704 four-colored diamondHealth 2: Intense or continued but not chronic exposure could cause temporary incapacitation or possible residual injury. E.g. chloroformFlammability 3: Liquids and solids that can be ignited under almost all ambient temperature conditions. Flash point between 23 and 38 °C (73 and 100 °F). E.g. gasolineInstability (yellow): no hazard codeSpecial hazards (white): no code
2 3
Flash point 15-20 °C
Related compounds
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound