Revision as of 16:20, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 475471115 of page 1,3-Bis(diphenylphosphino)propane for the Chem/Drugbox validation project (updated: '').← Previous edit | Revision as of 16:21, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 474812773 of page 1,3-Butadiene 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 | ||
| Verifiedfields = changed | | Verifiedfields = changed | ||
| Watchedfields = changed | |||
| verifiedrevid = |
| verifiedrevid = 456363375 | ||
|ImageFile=Dppp.png | |||
| Name = 1,3-Butadiene | |||
|ImageSize=200px | |||
| ImageFileL1 = Butadiène.PNG | |||
|ImageFile1=Dppp-from-xtal-2005-3D-balls.png | |||
| ImageSizeL1 = 120px | |||
|IUPACName=Propane-1,3-diylbis(diphenylphosphane) | |||
| ImageNameL1 = 1,3-Butadiene | |||
|OtherNames= | |||
| ImageFileR1 = Butadiene-skeletal.png | |||
⚫ | |Section1={{Chembox Identifiers | ||
| |
| ImageSizeR1 = 120px | ||
| ImageNameR1 = 1,3-Butadiene | |||
⚫ | | |
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| ImageFile2 = 1,3-Butadiene-3d.png | |||
⚫ | | ChemSpiderID = |
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| ImageSize2 = 150px | |||
| InChI = 1/C27H26P2/c1-5-14-24(15-6-1)28(25-16-7-2-8-17-25)22-13-23-29(26-18-9-3-10-19-26)27-20-11-4-12-21-27/h1-12,14-21H,13,22-23H2 | |||
| IUPACName = Buta-1,3-diene | |||
| InChIKey = LVEYOSJUKRVCCF-UHFFFAOYAP | |||
| OtherNames = Biethylene<br />Erythrene<br />Divinyl<br />Vinylethylene | |||
| SMILES1 = c1ccc(cc1)P(CCCP(c2ccccc2)c3ccccc3)c4ccccc4 | |||
⚫ | | Section1 = {{Chembox Identifiers | ||
| UNII_Ref = {{fdacite|correct|FDA}} | |||
| UNII = JSD5FGP5VD | |||
| SMILES = C=CC=C | |||
⚫ | | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} | ||
| ChEBI_Ref = {{ebicite|correct|EBI}} | |||
| ChEBI = 39478 | |||
⚫ | | ChemSpiderID = 7557 | ||
| KEGG_Ref = {{keggcite|correct|kegg}} | |||
| KEGG = C16450 | |||
| InChI = 1/C4H6/c1-3-4-2/h3-4H,1-2H2 | |||
| InChIKey = KAKZBPTYRLMSJV-UHFFFAOYAZ | |||
| ChEMBL_Ref = {{ebicite|changed|EBI}} | | ChEMBL_Ref = {{ebicite|changed|EBI}} | ||
| ChEMBL = |
| ChEMBL = 537970 | ||
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} | | StdInChI_Ref = {{stdinchicite|correct|chemspider}} | ||
| StdInChI = 1S/ |
| StdInChI = 1S/C4H6/c1-3-4-2/h3-4H,1-2H2 | ||
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | ||
| StdInChIKey = |
| StdInChIKey = KAKZBPTYRLMSJV-UHFFFAOYSA-N | ||
| CASNo_Ref = {{cascite|correct|CAS}} | | CASNo_Ref = {{cascite|correct|CAS}} | ||
| CASNo= |
| CASNo = 106-99-0 | ||
| UNNumber = ] | |||
⚫ | | |
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| RTECS = EI9275000 | |||
| SMILES = P(c1ccccc1)(c2ccccc2)CCCP(c3ccccc3)c4ccccc4 | |||
⚫ | | PubChem = 7845 | ||
⚫ | }} | ||
⚫ | | Section2 = {{Chembox Properties | ||
| Formula = C<sub>4</sub>H<sub>6</sub> | |||
| MolarMass = 54.0916 | |||
| Appearance = Colourless gas<br /> or refrigerated liquid | |||
| Density = 0.64 g/cm<sup>3</sup> at -6 °C, liquid | |||
⚫ | | Solubility = 735 ppm | ||
| MeltingPt = -108.9 °C, 164.3 K, -164.0 °F | |||
| BoilingPtC = -4.4 | |||
| Viscosity = 0.25 c] at 0 °C | |||
⚫ | }} | ||
⚫ | | Section3 = {{Chembox Structure | ||
| Dipole = | |||
}} | |||
| Section7 = {{Chembox Hazards | |||
| ExternalMSDS = | |||
| MainHazards = Flammable, irritative, ] | |||
⚫ | | FlashPt = -85 °C | ||
| RPhrases = {{R45}} {{R46}} {{R12}} | |||
| SPhrases = {{S45}} {{S53}} | |||
}} | |||
| Section8 = {{Chembox Related | |||
| Function = ]<br /> and ] | |||
| OtherFunctn = ]<br />] | |||
| OtherCpds = ] | |||
}} | }} | ||
⚫ | |Section2={{Chembox Properties | ||
| C = 27 | H = 26 | P = 2 | |||
| Appearance= white solid | |||
| Density= | |||
| MeltingPt= | |||
| BoilingPt= | |||
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⚫ | |Section3={{Chembox |
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| MainHazards= | |||
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| Autoignition= | |||
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}} | }} |
Revision as of 16:21, 16 February 2012
This page contains a copy of the infobox ({{chembox}}) taken from revid 474812773 of page 1,3-Butadiene with values updated to verified values. |
| |||
Names | |||
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IUPAC name Buta-1,3-diene | |||
Other names
Biethylene Erythrene Divinyl Vinylethylene | |||
Identifiers | |||
CAS Number | |||
3D model (JSmol) | |||
ChEBI | |||
ChEMBL | |||
ChemSpider | |||
KEGG | |||
PubChem CID | |||
RTECS number |
| ||
UNII | |||
UN number | 1010 | ||
InChI
| |||
SMILES
| |||
Properties | |||
Chemical formula | C4H6 | ||
Molar mass | 54.0916 | ||
Appearance | Colourless gas or refrigerated liquid | ||
Density | 0.64 g/cm at -6 °C, liquid | ||
Melting point | -108.9 °C, 164.3 K, -164.0 °F | ||
Boiling point | −4.4 °C (24.1 °F; 268.8 K) | ||
Solubility in water | 735 ppm | ||
Viscosity | 0.25 cP at 0 °C | ||
Hazards | |||
Occupational safety and health (OHS/OSH): | |||
Main hazards | Flammable, irritative, carcinogen | ||
Flash point | -85 °C | ||
Related compounds | |||
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). N verify (what is ?) Infobox references |
Chemical compound