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Revision as of 12:24, 15 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 474000857 of page Trimethylamine_N-oxide for the Chem/Drugbox validation project (updated: '').← Previous edit		Revision as of 12:24, 15 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 476725711 of page 2,4-Dichlorophenoxyacetic_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
			\| Watchedfields = changed
	\| Name=Trimethylamine ''N''-oxide
	\| verifiedrevid = ~~470615425~~		\| verifiedrevid = 443312208
			\| Name = 2,4-Dichlorophenoxyacetic acid
	\| ~~ImageFile_Ref~~ = {{chemboximage\|correct\|??}}		\| ImageFile1_Ref = {{chemboximage\|correct\|??}}
	\| ImageFile=Trimethylaminoxid.svg
			\| ImageFile1 = 2,4-Dichlorophenoxyacetic acid structure.svg
	\|ImageSize= 150
			\| ImageName1 = 2,4-Dichlorophenoxyacetic acid
	\|PIN= ''N'',''N''-dimethylmethanamine oxide
			\| ImageFile2 = 2,4-Dichlorophenoxyacetic acid Tubes.PNG
	\|IUPACName= trimethylamine oxide
			\| ImageName2 = 2,4-Dichlorophenoxyacetic acid in 3-D
	\|OtherNames= trimethylamine oxide, TMAO, TMANO
			\| IUPACName = (2,4-dichlorophenoxy)acetic acid
⚫	\|Section1={{Chembox Identifiers
			\| OtherNames = 2,4-D<br />hedonal<br />trinoxol
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
		⚫	\| Section1 = {{Chembox Identifiers
⚫	\| ChemSpiderID = ~~1113~~
	\| ~~UNII_Ref~~ = {{~~fdacite~~\|correct\|~~FDA~~}}		\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| ~~UNII~~ = ~~FLD0K1SJ1A~~		\| ChEBI = 28854
		⚫	\| SMILES = Clc1cc(Cl)ccc1OCC(=O)O
			\| PubChem = 1486
	\| KEGG_Ref = {{keggcite\|correct\|kegg}}		\| KEGG_Ref = {{keggcite\|correct\|kegg}}
	\| KEGG = ~~C01104~~		\| KEGG = C03664
	\| InChI = 1/~~C3H9NO~~/c1-4(2,3)5/h1-~~3H3~~		\| InChI = 1/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
	\| InChIKey = ~~UYPYRKYUKCHHIB~~-~~UHFFFAOYAU~~		\| InChIKey = OVSKIKFHRZPJSS-UHFFFAOYAM
		⚫	\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
			\| ChEMBL = 367623
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C3H9NO~~/c1-4(2,3)5/h1-~~3H3~~		\| StdInChI = 1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~UYPYRKYUKCHHIB~~-UHFFFAOYSA-N		\| StdInChIKey = OVSKIKFHRZPJSS-UHFFFAOYSA-N
	\| CASNo_Ref = {{cascite\|correct\|CAS}}		\| CASNo = 94-75-7
			\| CASNo_Ref = {{cascite\|correct\|CAS}}
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| CASNo= 1184-78-7
		⚫	\| ChemSpiderID = 1441
	\| PubChem= 1145
			\| RTECS =
⚫	\| ~~ChEBI_Ref~~ = {{ebicite\|correct\|EBI}}
		⚫	}}
	\| ChEBI = 15724
		⚫	\| Section2 = {{Chembox Properties
⚫	\| SMILES = C(C)(C)
			\| C=8\|H=6\|Cl=2\|O=3
⚫	}}
		⚫	\| MolarMass = 221.04 g/mol
⚫	\|Section2={{Chembox Properties
			\| Appearance = white to yellow powder
	\| C=3 \| H = 9 \| N = 1 \| O = 1
		⚫	\| Solubility = 900 mg/L
⚫	\| MolarMass=75.11
			\| MeltingPtC = 140.5
	\| Appearance= colourless solid
			\| BoilingPtC = 160
	\| Density=
			\| Boiling_notes = 0.4 mm Hg
	\| MeltingPt= 220–222 °C (hydrate: 96 °C)
	\| ~~BoilingPt~~=		\| pKa =
		⚫	}}
⚫	\| Solubility= ~~good~~
			\| Section3 = {{Chembox Structure
⚫	}}
			\| CrystalStruct =
			\| Dipole =
			}}
			\| Section7 = {{Chembox Hazards
			\| ExternalMSDS =
			\| MainHazards =
			\| FlashPt =
			\| RPhrases =
			\| SPhrases =
			}}
			\| Section8 = {{Chembox Related
			\| OtherCpds = ], ]
			}}
	}}		}}

Revision as of 12:24, 15 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 476725711 of page 2,4-Dichlorophenoxyacetic_acid with values updated to verified values.

2,4-Dichlorophenoxyacetic acid
Names


IUPAC name (2,4-dichlorophenoxy)acetic acid
Other names 2,4-D hedonal trinoxol
Identifiers
CAS Number	94-75-7
3D model (JSmol)	Interactive image
ChEBI	CHEBI:28854
ChEMBL	ChEMBL367623
ChemSpider	1441
KEGG	C03664
PubChem CID	1486
InChI InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)Key: OVSKIKFHRZPJSS-UHFFFAOYSA-N InChI=1/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)Key: OVSKIKFHRZPJSS-UHFFFAOYAM
SMILES Clc1cc(Cl)ccc1OCC(=O)O
Properties
Chemical formula	C₈H₆Cl₂O₃
Molar mass	221.04 g/mol
Appearance	white to yellow powder
Melting point	140.5 °C (284.9 °F; 413.6 K)
Boiling point	160 °C (320 °F; 433 K)
Solubility in water	900 mg/L
Related compounds
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

Chemical compound