| Revision as of 10:48, 9 April 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 485814301 of page Bibenzyl for the Chem/Drugbox validation project (updated: 'ChEMBL', 'ChEBI').← Previous edit |
Revision as of 10:49, 9 April 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 448002428 of page Bibrocathol for the Chem/Drugbox validation project (updated: 'StdInChI', 'StdInChIKey', 'CAS_number').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|drugbox}}) taken from revid of page ] with values updated to verified values.}} |
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{{Chembox |
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{{Drugbox |
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| IUPAC_name = 4,5,6,7-tetrabromo-2-hydroxy-1,3,2-benzodioxabismole |
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| ImageFile = Bibenzyl.svg |
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| image = Bibrocathol structure.svg |
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| ImageSize = 200px |
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| IUPACName = 1,1’-Ethane-1,2-diyldibenzene |
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<!--Clinical data--> |
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| OtherNames = Dibenzil; Dibenzyl; Dihydrostilbene; 1,2-Diphenylethane; ''sym''-Diphenylethane |
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| tradename = |
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| Section1 = {{Chembox Identifiers |
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| Drugs.com = {{drugs.com|international|bibrocathol}} |
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| CASNo = 103-29-7 |
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| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X --> |
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| CASNo_Ref = {{cascite|correct|CAS}} |
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| pregnancy_US = <!-- A / B / C / D / X --> |
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| ChEMBL = 440895 |
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| pregnancy_category = |
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| ChEBI = 34047 |
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| legal_AU = <!-- S2, S3, S4, S5, S6, S7, S8, S9 or Unscheduled--> |
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| PubChem = 7647 |
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| legal_CA = <!-- Schedule I, II, III, IV, V, VI, VII, VIII --> |
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| ChemSpiderID = 7364 |
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| legal_UK = <!-- GSL, P, POM, CD, or Class A, B, C --> |
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| SMILES = c1ccc(cc1)CCc2ccccc2 |
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| legal_US = <!-- OTC / Rx-only / Schedule I, II, III, IV, V --> |
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| InChI = 1/C14H14/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
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| legal_status = |
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| InChIKey = QWUWMCYKGHVNAV-UHFFFAOYAL |
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| routes_of_administration = Topical (eye ointment) |
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| StdInChI = 1S/C14H14/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
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| StdInChIKey = QWUWMCYKGHVNAV-UHFFFAOYSA-N |
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<!--Pharmacokinetic data--> |
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}} |
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| bioavailability = |
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| Section2 = {{Chembox Properties |
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| protein_bound = |
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| C=14|H=14 |
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| metabolism = |
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| Appearance = Crystalline solid<ref name=Merck>'']'', 11th Edition, '''1219'''</ref> |
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| elimination_half-life = |
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| Density = 0.9782 g/cm<sup>3</sup><ref name=Merck/> |
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| MeltingPtCL = 52.0 |
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| excretion = |
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| MeltingPtCL = 52.5 |
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<!--Identifiers--> |
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| Melting_notes = <ref name=Merck/> |
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| CAS_number = <!-- blanked - oldvalue: 6915-57-7 --> |
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| BoilingPtC = 284 |
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| ATC_prefix = S01 |
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| Boiling_notes = <ref name=Merck/> |
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| ATC_suffix = AX05 |
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| Solubility = Insoluble |
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| StdInChI = 1S/C6H2Br4O2.Bi.H2O/c7-1-2(8)4(10)6(12)5(11)3(1)9;;/h11-12H;;1H2/q;+3;/p-3 |
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| StdInChIKey = VTAVFIZOZUAKKE-UHFFFAOYSA-K |
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| Section3 = {{Chembox Hazards |
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| PubChem = 16683103 |
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| MainHazards = |
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| FlashPt = |
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| DrugBank = |
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| ChemSpiderID = 11232581 |
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| Autoignition = |
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| UNII_Ref = {{fdacite|correct|FDA}} |
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}} |
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| UNII = 0KJ20H1BLJ |
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| ChEMBL = 44875 |
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<!--Chemical data--> |
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| chemical_formula = |
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| C=6 | H=1 | Bi=1 | Br=4 | O=3 |
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| molecular_weight = 650.675 g/mol |
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| smiles = O1Oc2c(Br)c(Br)c(Br)c(Br)c2O1 |
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| InChI = 1/C6H2Br4O2.Bi.H2O/c7-1-2(8)4(10)6(12)5(11)3(1)9;;/h11-12H;;1H2/q;+3;/p-3/rC6HBiBr4O3/c8-1-2(9)4(11)6-5(3(1)10)13-7(12)14-6/h12H |
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| InChIKey = VTAVFIZOZUAKKE-AJXSUKGNAS |
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| synonyms = Bibrocathin<br>Tetrabromopyrocatechol bismuth |
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}} |
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}} |
