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Revision as of 19:48, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 476653810 of page Acesulfame_potassium for the Chem/Drugbox validation project (updated: '').← Previous edit Revision as of 19:48, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 476023192 of page Acetaldehyde 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 = 449102182 | verifiedrevid = 464364251
| ImageFileR1 = Acetaldehyde-tall-2D-skeletal.png
| ImageFile = AcesulfameK.svg
| ImageSize = 200px | ImageSizeR1 = 75px
| ImageNameR1 = Skeletal structure of acetaldehyde
| ImageName = Acesulfame potassium
| ImageFile1 = Acesulfame-k-ball-and-stick.png | ImageFileL2 = Acetaldehyde-3D-balls.png
| ImageSize1 = 200px | ImageSizeL2 = 125px
| ImageName1 = Ball-and-stick model of acesulfame potassium | ImageNameL2 = Ball-and-stick model
| ImageFileL1 = Acetaldehyde-2D-flat.png
| IUPACName = potassium 6-methyl-2,2-dioxo-2''H''-1,2λ<sup>6</sup>,3-oxathiazin-4-olate
| ImageNameL1 = Lewis structure of acetaldehyde
| OtherNames = Acesulfame K
| ImageSizeL1 = 132px
Ace K
| ImageFileR2 = Acetaldehyde-3D-vdW.png
| ImageNameR2 = Space-filling model
| IUPACName = ethanal
| SystemicName = ethanal
| OtherNames=Acetic Aldehyde<br>Ethyl Aldehyde<ref>SciFinderScholar (accessed Nov 4, 2009). Acetaldehyde (75-07-0) Substance Detail.</ref>
| Section1 = {{Chembox Identifiers | Section1 = {{Chembox Identifiers
| ChEBI_Ref = {{ebicite|correct|EBI}}
⚫ | EINECS = 259-715-3
| ChEBI = 15343
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| SMILES = O=CC
⚫ | ChemSpiderID = 11262939
| PubChem = 177
| UNII_Ref = {{fdacite|correct|FDA}} | UNII_Ref = {{fdacite|correct|FDA}}
| UNII = 23OV73Q5G9 | UNII = GO1N1ZPR3B
| KEGG_Ref = {{keggcite|correct|kegg}}
| InChI = 1/C4H5NO4S.K/c1-3-2-4(6)5-10(7,8)9-3;/h2H,1H3,(H,5,6);/q;+1
| KEGG = C00084
| InChIKey = WBZFUFAFFUEMEI-UHFFFAOYAZ
| InChI = 1/C2H4O/c1-2-3/h2H,1H3
| InChIKey = IKHGUXGNUITLKF-UHFFFAOYAB
| SMILES1 = CC=O
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C4H5NO4S.K/c1-3-2-4(6)5-10(7,8)9-3;/h2H,1H3,(H,5,6);/q;+1 | StdInChI = 1S/C2H4O/c1-2-3/h2H,1H3
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = WBZFUFAFFUEMEI-UHFFFAOYSA-N | StdInChIKey = IKHGUXGNUITLKF-UHFFFAOYSA-N
| CASNo_Ref = {{cascite|correct|CAS}} | ChEMBL_Ref = {{ebicite|correct|EBI}}
| CASNo = 55589-62-3 | ChEMBL = 170365
| PubChem = 23683747 | CASNo = 75-07-0
| CASNo_Ref = {{cascite|correct|CAS}}
| SMILES = .C\C1=C\C(=O)NS(=O)(=O)O1
⚫ | EINECS = 200-836-8
⚫ }}
| RTECS = AB1925000
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | ChemSpiderID=172
}}
| Section2 = {{Chembox Properties | Section2 = {{Chembox Properties
| C=2|H=4|O=1
| Formula = C<sub>4</sub>H<sub>4</sub>KNO<sub>4</sub>S
| Appearance = Colourless liquid<br />Pungent, fruity odor
| MolarMass = 201.242
⚫ | Density = 0.788 g cm<sup>−3</sup>
| Appearance = white crystalline powder
| Solubility = soluble in all proportions
⚫ | Density = 1.81 g/cm<sup>3</sup>
| MeltingPtC = 225 | MeltingPtC = −123.5
| BoilingPtC = 20.2
| BoilingPt =
| Solubility = 270 g/L at 20 °C | Viscosity = ~0.215 at 20 °C

}}
| Section3 = {{Chembox Structure
| MolShape = trigonal planar (sp²) at C<sub>1</sub><br />tetrahedral (sp³) at C<sub>2</sub>
| Dipole = 2.7 ]
}}
| Section4 = {{Chembox Thermochemistry
| DeltaHf = −166&nbsp;kJ·mol<sup>−1</sup>
| Entropy = 250&nbsp;J·mol<sup>−1</sup>·K<sup>−1</sup>
⚫ }}
| Section7 = {{Chembox Hazards
| GHSPictograms = {{GHSp|GHS02}}{{GHSp|GHS07}}{{GHSp|GHS08}}<ref name="sigma">{{SigmaLink
| Productgroup = Fluka
| Productcode = 00070
| Accessdate = May 26, 2011
}}</ref>
| HPhrases = {{H-phrases|224|319|335|351}}<ref name="sigma" />
| PPhrases = {{P-phrases|210|261|281|305+351+338}}<ref name="sigma" />
| EUClass = Very flammable ('''F+''')<br />Harmful ('''Xn''')<br />]
| NFPA-H = 2
| NFPA-F = 4
| NFPA-R = 2
| RPhrases = {{R12}} {{R36/37}} {{R40}}
| SPhrases = {{S2}} {{S16}} {{S33}} {{S36/37}}
| FlashPt = 234,15 K (-39 °C)
⚫ | Autoignition = 458,15 K (185 °C)
}} }}
| Section3 = {{Chembox Hazards | Section8 = {{Chembox Related
| Function = ]s
| MainHazards =
| OtherFunctn = ]<br /> ]
| FlashPt =
| OtherCpds = ]
⚫ | Autoignition =
}} }}
}} }}

Revision as of 19:48, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 476023192 of page Acetaldehyde with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Lewis structure of acetaldehyde
Lewis structure of acetaldehyde
Skeletal structure of acetaldehyde
Skeletal structure of acetaldehyde
Ball-and-stick model
Ball-and-stick model
Space-filling model
Space-filling model
Names
IUPAC name ethanal
Other names Acetic Aldehyde
Ethyl Aldehyde
Identifiers
CAS Number
3D model (JSmol)
ChEBI
ChEMBL
ChemSpider
EC Number
  • 200-836-8
KEGG
PubChem CID
RTECS number
  • AB1925000
UNII
InChI
  • InChI=1S/C2H4O/c1-2-3/h2H,1H3Key: IKHGUXGNUITLKF-UHFFFAOYSA-N
  • InChI=1/C2H4O/c1-2-3/h2H,1H3Key: IKHGUXGNUITLKF-UHFFFAOYAB
SMILES
  • O=CC
  • CC=O
Properties
Chemical formula C2H4O
Molar mass 44.053 g·mol
Appearance Colourless liquid
Pungent, fruity odor
Density 0.788 g cm
Melting point −123.5 °C (−190.3 °F; 149.7 K)
Boiling point 20.2 °C (68.4 °F; 293.3 K)
Solubility in water soluble in all proportions
Viscosity ~0.215 at 20 °C
Structure
Molecular shape trigonal planar (sp²) at C1
tetrahedral (sp³) at C2
Dipole moment 2.7 D
Thermochemistry
Std molar
entropy (S298) 		250 J·mol·K
Std enthalpy of
formation (ΔfH298) 		−166 kJ·mol
Hazards
GHS labelling:
Pictograms class="wikitable collapsible" style="min-width: 50em;"
GHS hazard pictograms
Pictogram Code Symbol description Image link
GHS01: Explosive GHS01 {{GHS exploding bomb}} Image:GHS-pictogram-explos.svg Explosive
GHS02: Flammable GHS02 {{GHS flame}} Image:GHS-pictogram-flamme.svg
GHS03: Oxidizing GHS03 {{GHS flame over circle}} Image:GHS-pictogram-rondflam.svg
GHS04: Compressed Gas GHS04 {{GHS gas cylinder}} Image:GHS-pictogram-bottle.svg
GHS05: Corrosive GHS05 {{GHS corrosion}} Image:GHS-pictogram-acid.svg Corrosive
GHS06: Toxic GHS06 {{GHS skull and crossbones}} Image:GHS-pictogram-skull.svg Accute Toxic
GHS07: Exclamation mark GHS07 {{GHS exclamation mark}} Image:GHS-pictogram-exclam.svg Irritant
GHS08: Health hazard GHS08 {{GHS health hazard}} Image:GHS-pictogram-silhouette.svg Health Hazard
GHS09: Environmental hazard GHS09 {{GHS environment}} Image:GHS-pictogram-pollu.svg Environment

See also

GHS hazard pictograms
Pictogram Code Symbol description Image link
GHS01: Explosive GHS01 {{GHS exploding bomb}} Image:GHS-pictogram-explos.svg Explosive
GHS02: Flammable GHS02 {{GHS flame}} Image:GHS-pictogram-flamme.svg
GHS03: Oxidizing GHS03 {{GHS flame over circle}} Image:GHS-pictogram-rondflam.svg
GHS04: Compressed Gas GHS04 {{GHS gas cylinder}} Image:GHS-pictogram-bottle.svg
GHS05: Corrosive GHS05 {{GHS corrosion}} Image:GHS-pictogram-acid.svg Corrosive
GHS06: Toxic GHS06 {{GHS skull and crossbones}} Image:GHS-pictogram-skull.svg Accute Toxic
GHS07: Exclamation mark GHS07 {{GHS exclamation mark}} Image:GHS-pictogram-exclam.svg Irritant
GHS08: Health hazard GHS08 {{GHS health hazard}} Image:GHS-pictogram-silhouette.svg Health Hazard
GHS09: Environmental hazard GHS09 {{GHS environment}} Image:GHS-pictogram-pollu.svg Environment

See also

GHS hazard pictograms
Pictogram Code Symbol description Image link
GHS01: Explosive GHS01 {{GHS exploding bomb}} Image:GHS-pictogram-explos.svg Explosive
GHS02: Flammable GHS02 {{GHS flame}} Image:GHS-pictogram-flamme.svg
GHS03: Oxidizing GHS03 {{GHS flame over circle}} Image:GHS-pictogram-rondflam.svg
GHS04: Compressed Gas GHS04 {{GHS gas cylinder}} Image:GHS-pictogram-bottle.svg
GHS05: Corrosive GHS05 {{GHS corrosion}} Image:GHS-pictogram-acid.svg Corrosive
GHS06: Toxic GHS06 {{GHS skull and crossbones}} Image:GHS-pictogram-skull.svg Accute Toxic
GHS07: Exclamation mark GHS07 {{GHS exclamation mark}} Image:GHS-pictogram-exclam.svg Irritant
GHS08: Health hazard GHS08 {{GHS health hazard}} Image:GHS-pictogram-silhouette.svg Health Hazard
GHS09: Environmental hazard GHS09 {{GHS environment}} Image:GHS-pictogram-pollu.svg Environment

See also

|-


|-

| style="padding-left:1em;" |

Hazard statements

| H224, H319, H335, H351

|-

|-

| style="padding-left:1em;" |

Precautionary statements

| P210, P261, P281, P305+P351+P338

|- | NFPA 704 (fire diamond)

|

NFPA 704 four-colored diamondHealth 2: Intense or continued but not chronic exposure could cause temporary incapacitation or possible residual injury. E.g. chloroformFlammability 4: Will rapidly or completely vaporize at normal atmospheric pressure and temperature, or is readily dispersed in air and will burn readily. Flash point below 23 °C (73 °F). E.g. propaneInstability 2: Undergoes violent chemical change at elevated temperatures and pressures, reacts violently with water, or may form explosive mixtures with water. E.g. white phosphorusSpecial hazards (white): no code
2 4 2

|- | Flash point | 234,15 K (-39 °C)

|- ! colspan=2 style="background: #f8eaba; text-align: center;" |Related compounds

|-


| colspan=2 style="text-align:left; background:#f8eaba; border:1px solid #a2a9b1;" |

Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references

|-

|}

Tracking categories (test):
Chemical compound
  1. SciFinderScholar (accessed Nov 4, 2009). Acetaldehyde (75-07-0) Substance Detail.
  2. ^ "Globally Harmonized System of Classification and Labelling of Chemicals" (pdf). 2021. Annex 3: Codification of Statements and Pictograms (pp 268–385).
  3. ^ Template:SigmaLink