This is an old revision of this page, as edited by Beetstra (talk | contribs) at 14:36, 21 November 2011 (Saving copy of the {{chembox}} taken from revid 443860316 of page Humulene for the Chem/Drugbox validation project (updated: 'ChEMBL').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.
Revision as of 14:36, 21 November 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 443860316 of page Humulene for the Chem/Drugbox validation project (updated: 'ChEMBL').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)This page contains a copy of the infobox ({{chembox}}) taken from revid 443860316 of page Humulene with values updated to verified values. |
Names | |
---|---|
IUPAC name 2,6,6,9-Tetramethyl-1,4-8-cycloundecatriene | |
Other names alpha-Caryophyllene; 3,7,10-Humulatriene | |
Identifiers | |
CAS Number | |
3D model (JSmol) | |
ChEBI | |
ChEMBL | |
ChemSpider | |
PubChem CID | |
InChI
| |
SMILES
| |
Properties | |
Chemical formula | C15H24 |
Molar mass | 204.357 g·mol |
Appearance | Pale yellowish green clear liquid |
Density | 0.886 g/cm |
Boiling point | 106-107 °C at 5 mmHg |
Hazards | |
Lethal dose or concentration (LD, LC): | |
LD50 (median dose) | >48 mg/kg |
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references |
Chemical compound
- Template:ChEMBL = 251280
- Merck Index, 12th Edition, 4789