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

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Revision as of 12:53, 15 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 476706588 of page Magnesium_sulfate for the Chem/Drugbox validation project (updated: 'ChEMBL').← Previous edit		Revision as of 12:53, 15 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 472900843 of page Erucic_acid 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.}}		{{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
	\| ~~Verifiedfields~~ = changed		\| Watchedfields = changed
	\| verifiedrevid = ~~464361855~~		\| verifiedrevid = 443733783
			\|ImageFile=Erucic acid.png
	\| Name = Magnesium sulfate
		⚫	\|ImageSize=300px
	\| ImageFile = Magnesium sulfate anhydrous.jpg
			\|IUPACName=(''Z'')-Docos-13-enoic acid
⚫	\| ImageSize = ~~200px~~
			\|OtherNames=
	\| ImageCaption = Anhydrous magnesium sulfate
		⚫	\|Section1= {{Chembox Identifiers
	\| ImageFile2 = Magnesium sulfate.JPG
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| ImageSize2 = 200px
		⚫	\| ChemSpiderID = 4444561
	\| ImageCaption2 = ] (heptahydrate)
	\| IUPACName = Magnesium sulfate
	\| OtherNames = Epsom salt<br/>Bitter salts
⚫	\| Section1 = {{Chembox Identifiers
	\| UNII_Ref = {{fdacite\|correct\|FDA}}		\| UNII_Ref = {{fdacite\|correct\|FDA}}
	\| UNII = ~~ML30MJ2U7I~~		\| UNII = 075441GMF2
	\| ~~ChEMBL_Ref~~ = {{~~ebicite~~\|~~changed~~\|~~EBI~~}}		\| KEGG_Ref = {{keggcite\|correct\|kegg}}
			\| KEGG = C08316
	\| ChEMBL = <!-- blanked - oldvalue: 1200456 -->
			\| InChI = 1/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-
	\| InChI = 1/Mg.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2
	\| InChIKey = ~~CSNNHWWHGAXBCP~~-~~NUQVWONBAQ~~		\| InChIKey = DPUOLQHDNGRHBS-KTKRTIGZBD
	\| ~~DrugBank_Ref~~ = {{~~drugbankcite~~\|correct\|~~drugbank~~}}		\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
	\| ~~DrugBank~~ = ~~DB00653~~		\| ChEMBL = 1173380
⚫	\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
⚫	\| ChEBI = ~~32599~~
	\| SMILES = .S()(=O)=O
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~Mg.H2O4S~~/~~c;1~~-5(2,3)4~~/h;~~(~~H2,1~~,2,3,4)/~~q+2;/p~~-2		\| StdInChI = 1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~CSNNHWWHGAXBCP~~-~~UHFFFAOYSA~~-L		\| StdInChIKey = DPUOLQHDNGRHBS-KTKRTIGZSA-N
	\| CASNo = 7487-88-9
	\| CASNo_Ref = {{cascite\|correct\|CAS}}		\| CASNo_Ref = {{cascite\|correct\|CAS}}
	\| ~~CASNo1~~ = ~~14168~~-73-1		\| CASNo=112-86-7
		⚫	\| PubChem=5281116
	\| CASNo1_Comment = (monohydrate)
		⚫	\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| CASNo2 = 24378-31-2
		⚫	\| ChEBI = 28792
	\| CASNo2_Comment = (tetrahydrate)
			\| SMILES = O=C(O)CCCCCCCCCCC\C=C/CCCCCCCC
	\| CASNo3 = 15553-21-6
		⚫	}}
	\| CASNo3_Comment = (pentahydrate)
		⚫	\|Section2= {{Chembox Properties
	\| CASNo4 = 13778-97-7
			\| C=22\|H=42\|O=2
	\| CASNo4_Comment = (hexahydrate)
		⚫	\| Appearance=White waxy solid
	\| CASNo5 = 10034-99-8
			\| Density=0.860 g/cm<sup>3</sup>
	\| CASNo5_Comment = (heptahydrate)
			\| MeltingPtC=33.8
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
			\| BoilingPt=381.5 °C (decomposes)
⚫	\| ChemSpiderID = ~~22515~~
			\| Solubility=Insoluble
⚫	\| PubChem = ~~24083~~
			\| SolubleOther = Soluble
	\| EINECS =
			\| Solvent = ] and ]
	\| RTECS = OM4500000
		⚫	}}
	\| ATCCode_prefix = A06
		⚫	\|Section3= {{Chembox Hazards
	\| ATCCode_suffix = AD04
			\| MainHazards=
	\| ATC_Supplemental = {{ATC\|A12\|CC02}} {{ATC\|B05\|XA05}} {{ATC\|D11\|AX05}} {{ATC\|V04\|CC02}}
			\| FlashPt= {{convert\|349.9\|C\|F}}
⚫	}}
			\| Autoignition=
⚫	\| Section2 = {{Chembox Properties
		⚫	}}
	\| Formula = MgSO<sub>4</sub>
⚫	\| Appearance = ~~white crystalline~~ solid
	\| Density = 2.66 g/cm<sup>3</sup> (anhydrous) <br /> 2.445 g/cm<sup>3</sup> (monohydrate) <br /> 1.68 g/cm<sup>3</sup> (heptahydrate)<br /> 1.512 g/cm<sup>3</sup> (11-hydrate)
	\| MolarMass = 120.366 g/mol (anhydrous)<br/>246.47 g/mol (heptahydrate)
	\| Solubility = ''anhydrous'' <br /> 269 g/L (0 °C) <br /> 255 g/L (20 °C) <hr> ''heptahydrate'' <br /> 710 g/L (20 °C)
	\| SolubleOther = 0.116 g/L (18 °C, ]) <br /> slightly soluble in ], ] <br /> insoluble in ]
	\| MeltingPt = 1124 °C (anhydrous, decomp) <br /> 200 °C (monohydrate, decomp) <br /> 150 °C (heptahydrate, decomp) <br /> 2 °C (11-hydrate, decomp)
	\| RefractIndex = 1.523 (monohydrate) <br /> 1.433 (heptahydrate)
⚫	}}
	\| Section3 = {{Chembox Structure
	\| Coordination =
	\| CrystalStruct = ] (hydrate)
⚫	}}
⚫	\| ~~Section7~~ = {{Chembox Hazards
	\| ExternalMSDS =
	\| EUIndex = Not listed
	}}
	\| Section8 = {{Chembox Related
	\| OtherCations = ]<br/>]<br/>]<br/>]
	\| OtherCpds =
	}}
	}}		}}

Revision as of 12:53, 15 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 472900843 of page Erucic_acid with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names

IUPAC name (Z)-Docos-13-enoic acid
Identifiers
CAS Number	112-86-7
3D model (JSmol)	Interactive image
ChEBI	CHEBI:28792
ChEMBL	ChEMBL1173380
ChemSpider	4444561
KEGG	C08316
PubChem CID	5281116
UNII	075441GMF2
InChI InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-Key: DPUOLQHDNGRHBS-KTKRTIGZSA-N InChI=1/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-Key: DPUOLQHDNGRHBS-KTKRTIGZBD
SMILES O=C(O)CCCCCCCCCCC\C=C/CCCCCCCC
Properties
Chemical formula	C₂₂H₄₂O₂
Molar mass	338.576 g·mol
Appearance	White waxy solid
Density	0.860 g/cm
Melting point	33.8 °C (92.8 °F; 306.9 K)
Boiling point	381.5 °C (decomposes)
Solubility in water	Insoluble
Solubility in methanol and ethanol	Soluble
Hazards
Flash point	349.9 °C (661.8 °F)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

Tracking categories (test):

SizeSet

Chemical compound