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Revision as of 16:57, 16 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 471997064 of page 2,3,7,8-Tetrachlorodibenzodioxin for the Chem/Drugbox validation project (updated: '').← Previous edit		Revision as of 16:58, 16 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 389514462 of page 2,3-Butanediol 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
	\| verifiedrevid = ~~443261380~~		\| verifiedrevid = 372005776
	\|ImageFile1=Dioxin-2D-skeletal.svg
			\| Name = 2,3-Butanediol
	\|ImageSize1=200px
			\| ImageFile = 2,3-Butanediol.png
	\|ImageFile2=Dioxin-3D-vdW.png
			\| ImageSize=150px
	\|ImageSize2=200px
			\| ImageName = 2,3-butanediol
	\|IUPACName=2,3,7,8-tetrachlorodibenzo-dioxin <ref>{{GoldBookRef\|title=dioxin\|file=D01750}}</ref>
			\| IUPACName = Butane-2,3-diol
	\|OtherNames=Tetradioxin; Tetrachlorodibenzodioxin; Tetrachlorodibenzo-''p''-dioxin
			\| OtherNames = 2,3-Butylene glycol<br />Dimethylene glycol<br />2,3-Dihydroxybutane<br />Butan-2,3-diol
	\|Section1={{Chembox Identifiers		\| Section1 = {{Chembox Identifiers
	\| Abbreviations = TCDD; TCDBD
		⚫	\| ChemSpiderID = 257
	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| ~~ChEBI_Ref~~ = {{~~ebicite\|correct\|EBI~~}}		\| CASNo_Ref = {{cascite}}
	\| ~~ChEBI~~ = ~~28119~~		\| CASNo = 513-85-9
		⚫	\| PubChem= 262
⚫	\| ChemSpiderID = ~~14865~~
			\| SMILES = CC(C(C)O)O
	\| KEGG_Ref = {{keggcite\|correct\|kegg}}
		⚫	}}
	\| KEGG = C07557
		⚫	\| Section2 = {{Chembox Properties
	\| InChI = 1/C12H4Cl4O2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H
		⚫	\| Formula = C<sub>4</sub>H<sub>10</sub>O<sub>2</sub>
	\| InChIKey = HGUFODBRKLSHSI-UHFFFAOYAA
		⚫	\| MolarMass = 90.121 g/mol
	\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
	\| ~~ChEMBL~~ = ~~30327~~		\| Density = 0.987 g/mL
			\| MeltingPt =
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
			\| BoilingPtC = 177
	\| StdInChI = 1S/C12H4Cl4O2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H
			}}
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
			\| Section7 = {{Chembox Hazards
	\| StdInChIKey = HGUFODBRKLSHSI-UHFFFAOYSA-N
			\| EUClass = Flammable ('''F''')
	\| CASNo_Ref = {{cascite\|correct\|CAS}}
			\| LD50 = 5462 mg/kg
	\| CASNo=1746-01-6
		⚫	\| NFPA-F = 3
⚫	\| PubChem=~~15625~~
			\| RPhrases = {{R11}}
	\| SMILES = Clc2cc1Oc3c(Oc1cc2Cl)cc(Cl)c(Cl)c3
			\| SPhrases = {{S2}} {{S7}} {{S16}}
⚫	}}
⚫	\|Section2={{Chembox Properties
⚫	\| Formula=C<sub>12</sub>H<sub>~~4</sub>Cl<sub>4~~</sub>O<sub>2</sub>
⚫	\| MolarMass=~~321~~.97 g/mol
	\| Appearance=
	\| Density = 1.8 g cm<sup>−3</sup>
	\| MeltingPtC = 305
	\| BoilingPt=
	\| Solubility=0.2 µg/L at 25 °C<ref>{{cite journal\|doi=10.1021/es00171a006\|author=Shiu WY ''et al''\|title=Physical-chemical properties of chlorinated dibenzo-p-dioxins\|journal=Environ Sci Technol\|volume= 22\|pages=651\|year=1988}}</ref>
	\| LogP = 6.8
	\| VaporPressure = 1.5 × 10<sup>−9</sup> mmHg
	}}		}}
	\|~~Section3~~={{Chembox ~~Hazards~~		\| Section8 = {{Chembox Related
			\| OtherFunctn = ]<br>]
	\| NFPA-H = 4
			\| Function =]s
⚫	\| NFPA-F = 1
	\| NFPA-R = 0
	\| NFPA-O =
	\| MainHazards=
	\| FlashPt= 164.2 °C
	\| Autoignition=
	}}		}}
	}}		}}

Revision as of 16:58, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 389514462 of page 2,3-Butanediol with values updated to verified values.

2,3-Butanediol
Names

IUPAC name Butane-2,3-diol
Other names 2,3-Butylene glycol Dimethylene glycol 2,3-Dihydroxybutane Butan-2,3-diol
Identifiers
CAS Number	513-85-9
3D model (JSmol)	Interactive image
ChemSpider	257
PubChem CID	262
SMILES CC(C(C)O)O
Properties
Chemical formula	C₄H₁₀O₂
Molar mass	90.121 g/mol
Density	0.987 g/mL
Boiling point	177 °C (351 °F; 450 K)
Hazards
NFPA 704 (fire diamond)	3
Lethal dose or concentration (LD, LC):
LD₅₀ (median dose)	5462 mg/kg
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

Tracking categories (test):

SizeSet

Chemical compound