Misplaced Pages:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox

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Revision as of 04:45, 17 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 470174115 of page Allyl_hexanoate for the Chem/Drugbox validation project (updated: 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)

This page contains a copy of the infobox ({{chembox}}) taken from revid 470174115 of page Allyl_hexanoate with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names

IUPAC name prop-2-enyl hexanoate
Other names Allyl caproate; Allyl n-caproate; 2-Propenyl n-hexanoate; Hexanoic acid, 2-propenyl ester
Identifiers
3D model (JSmol)	Interactive image Interactive image
ChemSpider	29006
EC Number	204-642-4
PubChem CID	31266
InChI InChI=1S/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3Key: RCSBILYQLVXLJG-UHFFFAOYSA-N InChI=1/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3Key: RCSBILYQLVXLJG-UHFFFAOYAX
SMILES CCCCCC(OCC=C)=O O=C(OCC=C)CCCCC
Properties
Chemical formula	C₉H₁₆O₂
Molar mass	156.225 g·mol
Appearance	Colorless to pale yellow clear liquid
Density	0.887 g/mL 0.884-0.892 g/mL
Boiling point	190-191 °C 75-76 °C (15 mmHg)
Solubility in water	Insoluble
Hazards
Flash point	66 °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):

Chemical compound