Revision as of 13:59, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,055 edits Saving copy of the {{chembox}} taken from revid 461589366 of page 1,2,4-Trimethylbenzene for the Chem/Drugbox validation project (updated: '').← Previous edit |
Revision as of 14:00, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,055 edits Saving copy of the {{chembox}} taken from revid 430733072 of page 1,2,4-Trioxane for the Chem/Drugbox validation project (updated: 'CASNo').Next edit → |
Line 1: |
Line 1: |
|
{{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 = 444391152 |
|
| verifiedrevid = 399179189 |
|
|
| Name = 1,2,4-Trioxane |
|
| Reference=<ref>'']'', 11th Edition, '''7929'''</ref> |
|
|
| Name = 1,2,4-Trimethylbenzene |
|
| ImageFile = 1,2,4-Trioxane.png |
|
|
| ImageSize = 80px |
|
| ImageFileL1 = 1,2,4-Trimethylbenzene.svg |
|
|
| ImageSizeL1 = 105px |
|
| ImageName = 1,2,4-Trioxane |
|
| ImageNameL1 = Skeletal formula |
|
| IUPACName = 1,2,4-Trioxane |
|
| ImageFileR1 = 1,2,4-Trimethylbenzene-3D-balls.png |
|
|
| ImageSizeR1 = 115px |
|
|
| ImageNameR1 = Ball-and-stick model |
|
|
| ImageName = 1,2,4-Trimethylbenzene |
|
|
| IUPACName = 1,2,4-Trimethylbenzene |
|
|
| OtherNames = Pseudocumene,<br />Asymmetrical trimethylbenzene,<br />psi-cumene |
|
|
| Section1 = {{Chembox Identifiers |
|
| Section1 = {{Chembox Identifiers |
|
⚫ |
| SMILES = C1COCOO1 |
|
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
|
| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
|
⚫ |
| ChemSpiderID = 10629025 |
|
| ChEBI_Ref = {{ebicite|correct|EBI}} |
|
|
⚫ |
| InChI = 1/C3H6O3/c1-2-5-6-3-4-1/h1-3H2 |
|
| ChEBI = 34039 |
|
|
|
| SMILES1 = C1OCCOO1 |
⚫ |
| ChemSpiderID = 6977 |
|
|
|
| InChIKey = FQERLIOIVXPZKH-UHFFFAOYAX |
|
| KEGG_Ref = {{keggcite|correct|kegg}} |
|
|
| KEGG = C14533 |
|
⚫ |
| InChI = 1/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3 |
|
|
| InChIKey = GWHJZXXIDMPWGX-UHFFFAOYAF |
|
|
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} |
|
| StdInChI_Ref = {{stdinchicite|correct|chemspider}} |
|
| StdInChI = 1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3 |
|
| StdInChI = 1S/C3H6O3/c1-2-5-6-3-4-1/h1-3H2 |
|
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
|
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
|
| StdInChIKey = GWHJZXXIDMPWGX-UHFFFAOYSA-N |
|
| StdInChIKey = FQERLIOIVXPZKH-UHFFFAOYSA-N |
|
|
| CASNo = <!-- blanked - oldvalue: 7049-17-4 --> |
|
| CASNo_Ref = {{cascite|correct|CAS}} |
|
|
| CASNo = 95-63-6 |
|
| RTECS = |
|
⚫ |
}} |
⚫ |
| SMILES = c1c(ccc(c1C)C)C |
|
⚫ |
}} |
|
|
| Section2 = {{Chembox Properties |
|
| Section2 = {{Chembox Properties |
|
|
| C=3|H=6|O=3 |
|
| Formula = C<sub>9</sub>H<sub>12</sub> |
|
|
| MolarMass = 120.19 g/mol |
|
| Appearance = |
|
| Density = 0.8761 g/cm³ |
|
| Density = |
|
| MeltingPt = -43.78 °C |
|
| Solubility = |
|
| BoilingPt = 169-171 °C |
|
| MeltingPt = |
|
|
| BoilingPt = |
|
|
}} |
|
⚫ |
| Section7 = {{Chembox Hazards |
|
|
| MainHazards = |
|
|
| FlashPt = |
|
|
| RPhrases = |
|
|
| SPhrases = |
|
|
}} |
|
|
| Section8 = {{Chembox Related |
|
|
| OtherCpds = ]<br />] |
|
}} |
|
}} |
⚫ |
| Section3 = {{Chembox Hazards |
|
|
| EUClass = Harmful (Xn); Dangerous for the environment (N) |
|
|
| ExternalMSDS = }} |
|
|
}} |
|
}} |