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

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Revision as of 13:40, 10 January 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 444407725 of page Tocofersolan for the Chem/Drugbox validation project (updated: 'CASNo').← Previous edit		Revision as of 13:40, 10 January 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 459240436 of page Tocopheryl_acetate 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
		⚫	\| verifiedrevid = 419011964
			\| ImageFile1 = Tocopheryl acetate.png
			\| ImageSize1 = 200px
			\| ImageFile2= Tocopheryl_acetate_3d_structure.png
			\| ImageSize2 = 200px
			\| IUPACName = chroman-6-yl] acetate
			\| OtherNames = Tocopherol acetate <br>Vitamin E acetate
		⚫	\| Section1 = {{Chembox Identifiers
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
		⚫	\| ChemSpiderID = 77987
	\| UNII_Ref = {{fdacite\|correct\|FDA}}		\| UNII_Ref = {{fdacite\|correct\|FDA}}
	\| UNII = ~~O03S90U1F2~~		\| UNII = A7E6112E4N
			\| InChI = 1/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3/t22-,23-,31-/m1/s1
⚫	\| verifiedrevid = ~~437190318~~
			\| InChIKey = ZAKOWWREFLAJOT-CEFNRUSXBQ
	\|ImageFile=Tocophersolan.png
			\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
	\|ImageSize=250px
			\| ChEMBL = 1047
	\|IUPACName=α--2''H''-1-benzopyran-6-yl]oxy]-1,4-dioxobutyl]-ω-hydroxy-poly(oxy-1,2-ethanediyl)
	\|OtherNames=Tocofersolan; Vitamin E PEG succinate; α-Tocopherol polyethylene glycol succinate; Liqui-E
⚫	\|Section1={{Chembox Identifiers
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
⚫	\| ChemSpiderID = ~~64498~~
	\| InChI1 = 1/C35H58O6/c1-24(2)12-9-13-25(3)14-10-15-26(4)16-11-20-35(8)21-19-30-29(7)33(27(5)28(6)34(30)41-35)40-32(38)18-17-31(37)39-23-22-36/h24-26,36H,9-23H2,1-8H3
	\| InChIKey1 = AOBORMOPSGHCAX-UHFFFAOYAU
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C35H58O6~~/c1-24(2)12-9-13-25(3)14-10-15-26(4)16-11-20-35(8)21-19-30-29(7)33(27(5)28(6)~~34(~~30~~)41-35)40-32~~(38)~~18-17~~-31~~(37)39~~-23-22-36/~~h24~~-26,~~36H,9~~-~~23H2~~,1-~~8H3~~		\| StdInChI = 1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3/t22-,23-,31-/m1/s1
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~AOBORMOPSGHCAX~~-~~UHFFFAOYSA~~-N		\| StdInChIKey = ZAKOWWREFLAJOT-CEFNRUSXSA-N
	\| CASNo = <!-- ~~blanked - oldvalue: 9002-96-4 -->~~		\| CASNo = 58-95-7
			\| CASNo_Ref = {{cascite\|correct\|CAS}}
	\| PubChem=9938056
	\| ~~ATCCode_prefix~~ = ~~A11~~		\| PubChem = 86472
		⚫	\| SMILES = O=C(Oc2c(c(c1O(CCc1c2C)(C)CCC(C)CCC(C)CCCC(C)C)C)C)C
	\| ATCCode_suffix = HA08
⚫	\| SMILES = O=C(~~OCCO)CCC(=O)~~Oc2c(c(~~c1OC~~(CCc1c2C)(C)~~CCCC~~(C)~~CCCC~~(C)CCCC(C)C)C)C
	}}		}}
	\|Section2={{Chembox Properties		\| Section2 = {{Chembox Properties
	\| Formula=(C<sub>2</sub>H<sub>4</sub>O)<sub>~~n</sub>C<sub>33</sub>H<sub>54</sub>O<sub>5~~</sub>		\| Formula = C<sub>31</sub>H<sub>52</sub>O<sub>3</sub>
	\| MolarMass=~~Variable~~		\| MolarMass = 472.743 g/mol
	\| Appearance=		\| Appearance =
	\| Density=		\| Density =
	\| MeltingPt=		\| MeltingPt =
	\| BoilingPt=		\| BoilingPt =
	\| Solubility=		\| Solubility =
	}}		}}
	\|Section3={{Chembox Hazards		\| Section3 = {{Chembox Hazards
	\| MainHazards=		\| MainHazards =
	\| FlashPt=		\| FlashPt =
	\| Autoignition=		\| Autoignition =
	}}		}}
	}}		}}

Revision as of 13:40, 10 January 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 459240436 of page Tocopheryl_acetate with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names


IUPAC name chroman-6-yl] acetate
Other names Tocopherol acetate Vitamin E acetate
Identifiers
CAS Number	58-95-7
3D model (JSmol)	Interactive image
ChEMBL	ChEMBL1047
ChemSpider	77987
PubChem CID	86472
UNII	A7E6112E4N
InChI InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3/t22-,23-,31-/m1/s1Key: ZAKOWWREFLAJOT-CEFNRUSXSA-N InChI=1/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3/t22-,23-,31-/m1/s1Key: ZAKOWWREFLAJOT-CEFNRUSXBQ
SMILES O=C(Oc2c(c(c1O(CCc1c2C)(C)CCC(C)CCC(C)CCCC(C)C)C)C)C
Properties
Chemical formula	C₃₁H₅₂O₃
Molar mass	472.743 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

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Chemical compound