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5,6-Diethenyl-1-methyl-cyclohexene
ScientificNameLabel
5,6-Diethenyl-1-methyl-cyclohexene
PHCD compound ID :
3134
Chemical Names :
5,6-Diethenyl-1-methyl-cyclohexene
Molecular Formula :
C11H16
Molecular Weight :
148.125201
More Details :
Names & Synonyms:
1-methyl-5,6-divinyl-cyclohexene , 5,6-bis(ethenyl)-1-methylcyclohexene , 5,6-bis(ethenyl)-1-methyl-cyclohexene
Smiles:
C=C[C@H]1[C@H](C=C)CCC=C1C
InChi :
InChI=1S/C11H16/c1-4-10-8-6-7-9(3)11(10)5-2/h4-5,7,10-11H,1-2,6,8H2,3H3/t10-,11-/m1/s1
InChi Key :
InChIKey=OPTHRYQKFFRAFP-GHMZBOCLSA-N
PubChem ID :
556490
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.298924
Hydrogen bond donor count :
0
Electric dipole moment :
0.298
XLogP :
4.484
VDW volume :
178.546455
Molecular weight :
148.125201
HOMO-LUMO gap :
10.244000
Herb list :
Rue - Ruta graveolens - سداب
Refrences & Litretures:
427. Journal:'Food Chemistry' Year:'2013' Volume:'141' Page:'253' DOI:'10.1016/j.foodchem.2013.03.007' Title:'Chemical composition and antimicrobial activity of the essential oils from four Ruta species growing in Algeria'
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