Revision as of 17:16, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 399296391 of page 2-Chloro-9,10-bis(phenylethynyl)anthracene for the Chem/Drugbox validation project (updated: 'CASNo').← Previous edit |
Revision as of 17:16, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 415301524 of page 2-Chloro-9,10-diphenylanthracene for the Chem/Drugbox validation project (updated: '').Next edit → |
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} |
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} |
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{{chembox |
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{{chembox |
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| verifiedrevid = 399295676 |
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| verifiedrevid = 399296473 |
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| Name = 2-chloro-9,10-diphenyl-anthracene |
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| ImageFile = 2-Chloro-BPEA.svg |
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| ImageFile = 2-chloro-9,10-diphenylanthracene.png |
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| ImageSize = 250px |
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| ImageSize = 150px |
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| ImageName = Skeletal formula |
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| ImageAlt = |
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| ImageFile1 = 2-Chloro-9,10-bis(phenylethynyl)anthracene-3D-balls.png |
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| ImageSize1 = 250px |
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| ImageName = |
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| IUPACName = 2-Chloro-9,10-diphenyl-anthracene |
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| ImageName1 = Ball-and-stick model |
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| OtherNames = |
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| IUPACName = 2-Chloro-9,10-bis(2-phenylethynyl)anthracene |
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| OtherNames = 2-Chloro-9,10-bis(phenylethynyl)anthracene, 2-Chloro-BPEA |
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| Section1 = {{Chembox Identifiers |
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| Section1 = {{Chembox Identifiers |
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| Abbreviations = |
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| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
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| InChIKey = PLMFIWDPKYXMGE-UHFFFAOYAZ |
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| ChemSpiderID = 286153 |
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| InChI = 1/C30H17Cl/c31-24-17-20-29-27(18-15-22-9-3-1-4-10-22)25-13-7-8-14-26(25)28(30(29)21-24)19-16-23-11-5-2-6-12-23/h1-14,17,20-21H |
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| InChIKey = YDYTTZZBQVZTPY-UHFFFAOYAF |
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| SMILES1 = Clc5ccc4c(C#Cc1ccccc1)c2ccccc2c(C#Cc3ccccc3)c4c5 |
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| StdInChI_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChI_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChI = 1S/C30H17Cl/c31-24-17-20-29-27(18-15-22-9-3-1-4-10-22)25-13-7-8-14-26(25)28(30(29)21-24)19-16-23-11-5-2-6-12-23/h1-14,17,20-21H |
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| StdInChI = 1S/C26H17Cl/c27-20-15-16-23-24(17-20)26(19-11-5-2-6-12-19)22-14-8-7-13-21(22)25(23)18-9-3-1-4-10-18/h1-17H |
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| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChIKey = YDYTTZZBQVZTPY-UHFFFAOYSA-N |
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| StdInChIKey = PLMFIWDPKYXMGE-UHFFFAOYSA-N |
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| CASNo = <!-- blanked - oldvalue: 41105-36-6 --> |
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| CASNo = |
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| PubChem = 323135 |
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| CASNo_Ref = |
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| CASNos = |
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| SMILES = c1ccc(cc1)C#Cc2c3ccc(cc3c(c4ccccc42)C#Cc5ccccc5)Cl |
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| CASOther = |
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}} |
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| PubChem = |
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| KEGG_Ref = {{keggcite|correct|kegg}} |
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| ChEBI = |
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| ATCvet = |
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| ATCCode_prefix = |
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| ATC_Supplemental = |
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| SMILES = Clc4ccc3c(c1ccccc1c(c2ccccc2)c3c4)c5ccccc5 |
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| InChI = 1/C26H17Cl/c27-20-15-16-23-24(17-20)26(19-11-5-2-6-12-19)22-14-8-7-13-21(22)25(23)18-9-3-1-4-10-18/h1-17H |
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| Beilstein = |
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| Gmelin = |
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| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
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| ChemSpiderID =549193 |
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| 3DMet =}} |
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| Section2 = {{Chembox Properties |
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| Section2 = {{Chembox Properties |
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| C=26 | H=17 | Cl=1 | |
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| Formula = C<sub>30</sub>H<sub>17</sub>Cl |
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| MolarMass = 412.91 g/mol |
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| Appearance = |
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| Appearance = |
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| Density = |
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| Density = |
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| MeltingPt = |
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| Melting_notes = |
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| MeltingPt = 224 - 226 °C |
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}} |
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| SolubleOther = |
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| Section3 = {{Chembox Hazards |
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| Solvent = |
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| MainHazards = Irritant ('''Xi''') |
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| RPhrases = {{R36/37/38}} |
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| LogP = |
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| SPhrases = {{S26}} |
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| VaporPressure = |
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| FlashPt = |
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| HenryConstant = |
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| Autoignition = |
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}} |
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| pKa = |
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| pKb = }} |
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| Section3 = {{Chembox Structure |
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| Section4 = {{Chembox Thermochemistry |
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| HeatCapacity = }} |
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| Section5 = {{Chembox Pharmacology |
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| PregCat_US = }} |
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| Section6 = {{Chembox Explosive |
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| ShockSens = |
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| ExplosiveV = |
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| REFactor = }} |
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| Section7 = {{Chembox Hazards |
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| ExternalMSDS = |
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| EUClass = |
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| MainHazards = |
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| NFPA-H = |
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| FlashPt = |
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| Autoignition = |
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| ExploLimits = |
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| LD50 = |
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| PEL = }} |
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| Section8 = {{Chembox Related |
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| OtherAnions = |
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| Function = |
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}} |
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}} |