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

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Revision as of 14:20, 10 January 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{drugbox}} taken from revid 469110865 of page Tripelennamine for the Chem/Drugbox validation project (updated: 'DrugBank').← Previous edit		Revision as of 14:20, 10 January 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 455783333 of page Triphenyl_phosphate for the Chem/Drugbox validation project (updated: '').Next edit →
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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.}}		{{ambox \| text = This page contains a copy of the infobox ({{tl\|chembox}}) taken from revid of page ] with values updated to verified values.}}
	{{~~Drugbox~~		{{chembox
	\| ~~Watchedfields~~ = changed		\| Verifiedfields = changed
	\| verifiedrevid = ~~417964219~~		\| verifiedrevid = 419120330
		⚫	\| ImageFile_Ref = {{chemboximage\|correct\|??}}
	\| IUPAC_name = ''N'',''N-dimethyl-''N''-(phenylmethyl)-''N''-pyridin-2-ylethane-1,2-diamine
			\| ImageFile = OP(OPh)3.png
	\| image = Tripelennamine2.svg
			\| ImageSize = 200px

			\| ImageFile1 = Triphenyl-phosphate-3D-vdW.png
	<!--Clinical data-->
			\| IUPACName = Triphenyl phosphate
	\| tradename =
			\| OtherNames =
	\| Drugs.com = {{drugs.com\|MTM\|tripelennamine}}
			\| Section1 = {{Chembox Identifiers
	\| MedlinePlus = a601044
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| pregnancy_AU = <!-- A / B1 / B2 / B3 / C / D / X -->
		⚫	\| ChemSpiderID = 7988
	\| pregnancy_US = <!-- A / B / C / D / X -->
			\| InChI = 1/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H
	\| pregnancy_category =
			\| InChIKey = XZZNDPSIHUTMOC-UHFFFAOYAB
	\| legal_AU = <!-- Unscheduled / S2 / S4 / S8 -->
		⚫	\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
	\| legal_UK = <!-- GSL / P / POM / CD -->
		⚫	\| ChEMBL = 454511
	\| legal_US = <!-- OTC / Rx-only -->
	\| legal_status = Rx-only
	\| routes_of_administration = Oral, Intravenous

	<!--Pharmacokinetic data-->
	\| bioavailability =
	\| protein_bound =
	\| metabolism = ] ] and ]
	\| elimination_half-life = 4-6 hours<ref name="GoldfrankFlomenbaum2006">{{cite book \| author1 = Lewis R. Goldfrank \| author2 = Neal Flomenbaum \| title = Goldfrank's toxicologic emergencies \| url = http://books.google.com/books?id=cvJuLqBxGUcC&pg=PA787 \| accessdate = 27 November 2011 \| year = 2006 \| publisher = McGraw-Hill Professional \| isbn = 978-0-07-147914-1 \| page = 787}}</ref>
	\| excretion = ]

	<!--Identifiers-->
⚫	\| CASNo_Ref = {{cascite\|correct\|CAS}}
⚫	\| ~~CAS_number_Ref~~ = {{~~cascite~~\|correct\|??}}
	\| CAS_number = 91-81-6
	\| CAS_supplemental = <br/>{{CAS\|154-69-8}} <small>(monohydrochloride)</small><br>{{CAS\|22306-05-4}} <small>(])</small><br>{{CAS\|57116-36-6}} <small>(])</small><br>{{CAS\| 6138-56-3}} <small>(])</small>
	\| ATC_prefix = D04
	\| ATC_suffix = AA04
	\| ATC_supplemental = {{ATC\|R06\|AC04}}
⚫	\| PubChem = ~~5587~~
	\| DrugBank_Ref = {{drugbankcite\|correct\|drugbank}}
	\| DrugBank = DB00792
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
⚫	\| ChemSpiderID = ~~5385~~
	\| UNII_Ref = {{fdacite\|correct\|FDA}}
	\| UNII = 3C5ORO99TY
	\| KEGG_Ref = {{keggcite\|correct\|kegg}}
	\| KEGG = D08645
⚫	\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
⚫	\| ChEMBL = ~~1241~~

	<!--Chemical data-->
	\| C = 16 \| H = 21 \| N = 3
	\| molecular_weight = 255.358 g/mol
	\| smiles = n1ccccc1N(CCN(C)C)Cc2ccccc2
	\| InChI = 1/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
	\| InChIKey = UFLGIAIHIAPJJC-UHFFFAOYAZ
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C16H21N3~~/c1-18(~~2)12~~-~~13-19(~~16-10-6-7-11-17-16)14-15-8-4-3-5-9-15~~/h3~~-~~11H,12-14H2,1~~-~~2H3~~		\| StdInChI =1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~UFLGIAIHIAPJJC~~-UHFFFAOYSA-N		\| StdInChIKey = XZZNDPSIHUTMOC-UHFFFAOYSA-N
		⚫	\| CASNo_Ref = {{cascite\|correct\|CAS}}
			\| CASNo = 115-86-6
		⚫	\| PubChem = 8289
			\| ChEBI_Ref = {{ebicite\|changed\|EBI}}
			\| ChEBI = 35033
			\| SMILES = O=P(Oc1ccccc1)(Oc2ccccc2)Oc3ccccc3
			}}
			\| Section2 = {{Chembox Properties
			\| Formula = C<sub>18</sub>H<sub>15</sub>O<sub>4</sub>P
			\| MolarMass = 326.28 g/mol
			\| Appearance = colourless liquid
			\| Density = 1.184 g/mL
			\| MeltingPt = 48-50 °C
			\| BoilingPt = 244 °C 10 mm Hg
			\| Solubility = organic solvents
			}}
			\| Section3 = {{Chembox Hazards
			\| MainHazards = harmful
			\| FlashPt =
			\| Autoignition =
			}}
	}}		}}

Revision as of 14:20, 10 January 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 455783333 of page Triphenyl_phosphate with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names


IUPAC name Triphenyl phosphate
Identifiers
CAS Number	115-86-6
3D model (JSmol)	Interactive image
ChEBI	CHEBI:35033
ChEMBL	ChEMBL454511
ChemSpider	7988
PubChem CID	8289
InChI InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15HKey: XZZNDPSIHUTMOC-UHFFFAOYSA-N InChI=1/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15HKey: XZZNDPSIHUTMOC-UHFFFAOYAB
SMILES O=P(Oc1ccccc1)(Oc2ccccc2)Oc3ccccc3
Properties
Chemical formula	C₁₈H₁₅O₄P
Molar mass	326.28 g/mol
Appearance	colourless liquid
Density	1.184 g/mL
Melting point	48-50 °C
Boiling point	244 °C 10 mm Hg
Solubility in water	organic solvents
Hazards
Occupational safety and health (OHS/OSH):
Main hazards	harmful
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):

SizeSet

Chemical compound