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

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Revision as of 17:19, 16 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 465031596 of page 2-Heptanol for the Chem/Drugbox validation project (updated: '').← Previous edit		Revision as of 17:20, 16 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 443315087 of page 2-Heptanone 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 = 443314270
	\| Watchedfields = changed
			\| Reference = <ref>, International Occupational Safety and Health Information Centre (CIS)</ref>
⚫	\| verifiedrevid = ~~443345893~~
			\| ImageFile_Ref = {{chemboximage\|correct\|??}}
	\|ImageFile=2-heptanol skeletal.png
			\| ImageFile = 2-heptanone.svg
	\|ImageSize=		\| ImageSize = 170px
⚫	\|IUPACName=Heptan-2-ol
			\| ImageName = Skeletal formula of 2-heptanone
	\|OtherNames=''s''-Heptyl alcohol
			\| ImageFile1 = 2-Heptanone-3D-balls.png
	\| Reference = <ref name="hand">
			\| ImageSize1 = 200px
	{{Citation
			\| ImageName1 = Ball-and-stick model of 2-heptanone
	\| last = Lide
		⚫	\| IUPACName = Heptan-2-one
	\| first = David R.
			\| OtherNames = Amyl methyl ketone<br>Butyl acetone<br>Methyl ''n''-amyl ketone<br>Methyl pentyl ketone
	\| author-link =
		⚫	\| Section1 = {{Chembox Identifiers
	\| last2 =
			\| UNII_Ref = {{fdacite\|correct\|FDA}}
	\| first2 =
			\| UNII = 89VVP1B008
	\| author2-link =
			\| KEGG_Ref = {{keggcite\|correct\|kegg}}
	\| publication-date =
	\| ~~date~~ =		\| KEGG = C08380
		⚫	\| InChI = 1/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
	\| year = 1998
			\| InChIKey = CATSNJVOTSVZJV-UHFFFAOYAO
	\| title = Handbook of Chemistry and Physics
	\| edition = 87
	\| volume =
	\| series =
	\| publication-place = Boca Raton, FL
	\| place =
	\| publisher = CRC Press
	\| id =
	\| isbn = 0-8493-0594-2
	\| doi =
	\| oclc =
	\| pages = 3-300, 6-189, 8-109, 16-25
	\| url =
	\| accessdate =
	}}</ref>
⚫	\|Section1={{Chembox Identifiers
⚫	\| InChI = 1/~~C7H16O~~/c1-3-4-5-6-7(2)8/~~h7-8H,3~~-6H2,1-2H3
	\| InChIKey = CETWDUZRCINIHU-UHFFFAOYAL
	\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}		\| ChEMBL_Ref = {{ebicite\|correct\|EBI}}
	\| ChEMBL = ~~449522~~		\| ChEMBL = 18893
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C7H16O~~/c1-3-4-5-6-7(2)8/~~h7-8H,3~~-6H2,1-2H3		\| StdInChI = 1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~CETWDUZRCINIHU~~-UHFFFAOYSA-N		\| StdInChIKey = CATSNJVOTSVZJV-UHFFFAOYSA-N
	\| CASNo_Ref = {{cascite\|correct\|CAS}}		\| CASNo_Ref = {{cascite\|correct\|CAS}}
	\| CASNo=~~543~~-49-7		\| CASNo = 110-43-0
	\| PubChem = ~~10976~~		\| PubChem = 8051
	\| ~~UNII_Ref~~ = {{~~fdacite~~\|correct\|~~FDA~~}}		\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| ~~UNII~~ = ~~E12FIG07JK~~		\| ChEBI = 5672
	\| SMILES = OC(C)CCCCC		\| SMILES = O=C(C)CCCCC
	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}		\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| ChemSpiderID = ~~10511~~		\| ChemSpiderID = 7760
	}}		}}
	\|Section2={{Chembox Properties		\| Section2 = {{Chembox Properties
	\| Formula=C<sub>7</sub>H<sub>16</sub>O		\| Formula = C<sub>7</sub>H<sub>14</sub>O
	\| MolarMass=~~116~~.~~201~~ g/mol		\| MolarMass = 114.18 g/mol
	\| Appearance=		\| Appearance = Clear liquid
	\| Density= 0.~~817~~ g/mL		\| Density = 0.8 g/mL
	\| MeltingPt=		\| MeltingPt = -35.5 °C
	\| BoilingPt= ~~159 ~~°C		\| BoilingPt = 151 °C
	\| Solubility= 3.3 ~~g/L~~		\| Solubility = 0.4% by wt
	\| SolubleOther = soluble in ], ]
	\| Viscosity = 3.955 mPa·s
	}}		}}
	\|Section3={{Chembox Hazards		\| Section3 = {{Chembox Hazards
	\| MainHazards=		\| MainHazards =
	\| FlashPt= ~~71 ~~°C		\| FlashPt = 39 °C
	\| Autoignition=		\| Autoignition = 393 °C
	}}		}}
	}}		}}

Revision as of 17:20, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 443315087 of page 2-Heptanone with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
Skeletal formula of 2-heptanone
Ball-and-stick model of 2-heptanone
IUPAC name Heptan-2-one
Other names Amyl methyl ketone Butyl acetone Methyl n-amyl ketone Methyl pentyl ketone
Identifiers
CAS Number	110-43-0
3D model (JSmol)	Interactive image
ChEBI	CHEBI:5672
ChEMBL	ChEMBL18893
ChemSpider	7760
KEGG	C08380
PubChem CID	8051
UNII	89VVP1B008
InChI InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3Key: CATSNJVOTSVZJV-UHFFFAOYSA-N InChI=1/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3Key: CATSNJVOTSVZJV-UHFFFAOYAO
SMILES O=C(C)CCCCC
Properties
Chemical formula	C₇H₁₄O
Molar mass	114.18 g/mol
Appearance	Clear liquid
Density	0.8 g/mL
Melting point	-35.5 °C
Boiling point	151 °C
Solubility in water	0.4% by wt
Hazards
Flash point	39 °C
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

Methyl n-amyl ketone, International Occupational Safety and Health Information Centre (CIS)