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Compound: 5546
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References: 992
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Bornylene
ScientificNameLabel
Bornylene
PHCD compound ID :
1538
Chemical Names :
Bornylene
Molecular Formula :
C10H16
Molecular Weight :
136.125201
More Details :
Names & Synonyms:
4,7,7-trimethylbicyclo[2.2.1]hept-2-ene
Smiles:
CC1(C)[C@H]2CC[C@]1(C)C=C2
InChi :
InChI=1S/C10H16/c1-9(2)8-4-6-10(9,3)7-5-8/h4,6,8H,5,7H2,1-3H3/t8-,10+/m1/s1
InChi Key :
InChIKey=KUKRLSJNTMLPPK-SCZZXKLOSA-N
PubChem ID :
10047
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.510803
Hydrogen bond donor count :
0
Electric dipole moment :
0.656
XLogP :
4.523
VDW volume :
154.166929
Molecular weight :
136.125201
HOMO-LUMO gap :
10.716000
Herb list :
Mount atlas pistache - Pistacia atlantica - بنه، پسته کوهی
Refrences & Litretures:
167. Journal:'Industrial Crops and Products' Year:'2010' Volume:'31' Page:'203' DOI:'10.1016/j.indcrop.2009.10.003' Title:'Antioxidant activities and chemical composition of essential oil of Pistacia atlantica from Algeria'
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