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Compound: 5546
Plants: 312
References: 992
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Bicyclo[3.1.0]hexane,6-isopropylidene-1-methyl
ScientificNameLabel
Bicyclo[3.1.0]hexane,6-isopropylidene-1-methyl
PHCD compound ID :
2472
Chemical Names :
Bicyclo[3.1.0]hexane,6-isopropylidene-1-methyl , 6-Isopropylidene-1-methyl-bicyclo[3.1.0]hexane, , 6-Isopropylidene-1-methyl-bicyclo[3.1.0]hexane
Molecular Formula :
C10H16
Molecular Weight :
136.125201
More Details :
Names & Synonyms:
6-isopropylidene-1-methyl-bicyclo[3.1.0]hexane , 1-methyl-6-propan-2-ylidenebicyclo[3.1.0]hexane , 1-methyl-6-propan-2-ylidene-bicyclo[3.1.0]hexane
Smiles:
CC(=C1[C@@H]2[C@@]1(C)CCC2)C
InChi :
InChI=1S/C10H16/c1-7(2)9-8-5-4-6-10(8,9)3/h8H,4-6H2,1-3H3/t8-,10-/m1/s1
InChi Key :
InChIKey=CSIZHOMQBOGEAV-PSASIEDQSA-N
PubChem ID :
578236
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.229918
Hydrogen bond donor count :
0
Electric dipole moment :
0.565
XLogP :
3.533
VDW volume :
154.166929
Molecular weight :
136.125201
HOMO-LUMO gap :
10.589000
Herb list :
Betony - Stachys lavandulifolia Vahl - چای کوهی، سنبله ای زیبا
Cumin - Cuminum cyminum - زیره سبز
Refrences & Litretures:
285. Journal:'Journal of Herbal Drugs' Year:'2013' Volume:'4' Page:'137' DOI:'' Title:'Phytochemical of essential oil of Stachys lavandulifolia Vahl. collected from a natural habitat in western Isfahan, Iran'
407. Journal:'Journal of Chromatography A' Year:'2006' Volume:'1102' Page:'11' DOI:'10.1016/j.chroma.2005.10.032' Title:'Improved solvent-free microwave extraction of essential oil from dried Cuminum cyminum L. and Zanthoxylum bungeanum Maxim'
410. Journal:'Food Chemistry' Year:'2009' Volume:'115' Page:'1114' DOI:'10.1016/j.foodchem.2008.12.091' Title:'Extraction of Cuminum cyminum essential oil by combination technology of organic solvent with low boiling point and steam distillation'
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