This is an old revision of this page, as edited by Beetstra (talk | contribs) at 19:57, 16 February 2012 (Saving copy of the {{chembox}} taken from revid 473754783 of page Acetylacetone for the Chem/Drugbox validation project (updated: '').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.
Revision as of 19:57, 16 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 473754783 of page Acetylacetone for the Chem/Drugbox validation project (updated: '').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)This page contains a copy of the infobox ({{chembox}}) taken from revid 473754783 of page Acetylacetone with values updated to verified values. |
{{chembox | verifiedrevid = 443366220 | ImageFile = AcacH.png | ImageSize = 260px | ImageName = Skeletal structures of both tautomers | ImageFileL1 = Acetylacetone-enol-3D-balls.png | ImageSizeL1 = 130px | ImageNameL1 = Ball-and-stick model of the enol tautomer | ImageFileR1 = Acetylacetone-keto-3D-balls.png | ImageSizeR1 = 130px | ImageNameR1 = Ball-and-stick model of the keto tautomer |IUPACName=Pentane-2,4-dione |OtherNames=Hacac |Section1=! colspan=2 style="background: #f8eaba; text-align: center;" |Identifiers
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CAS Number|
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|
3D model (JSmol)|
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| ChEBI
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|- | ChEMBL
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|- | ChemSpider
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| KEGG
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| UNII
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|-
| colspan="2" |
InChI- InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3Key: YRKCREAYFQTBPV-UHFFFAOYSA-N
- InChI=1/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3Key: YRKCREAYFQTBPV-UHFFFAOYAO
|-
| colspan="2" |
SMILES- O=C(C)CC(=O)C
- CC(=O)CC(=O)C
|- |Section4=! colspan=2 style="background: #f8eaba; text-align: center;" |Properties
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|
Chemical formula| C5H8O2
|- | Molar mass
| 100.13 g/mol
|-
| Density
| 0.98 g/mL
|-
| Melting point
| −23 °C
|- | Boiling point | 140 °C
|-
|
Solubility in water| 16 g/100 mL |- |Section15=! colspan=2 style="background: #f8eaba; text-align: center;" |Hazards
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| NFPA 704 (fire diamond)
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2 2 0|- | Flash point | 34 °C
|-
| Explosive limits | 2.4–11.6% |- }