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Triethylbenzene
ScientificNameLabel
Triethylbenzene
PHCD compound ID :
3974
Chemical Names :
Triethylbenzene
Molecular Formula :
C12H18
Molecular Weight :
162.140851
More Details :
Names & Synonyms:
1,2,3-triethylbenzene
Smiles:
CCc1c(CC)cccc1CC
InChi :
InChI=1S/C12H18/c1-4-10-8-7-9-11(5-2)12(10)6-3/h7-9H,4-6H2,1-3H3
InChi Key :
InChIKey=VIDOPANCAUPXNH-UHFFFAOYSA-N
PubChem ID :
39149
Rotatable bond count :
3
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
9.149584
Hydrogen bond donor count :
0
Electric dipole moment :
0.963
XLogP :
4.65
VDW volume :
184.942439
Molecular weight :
162.140851
HOMO-LUMO gap :
9.682000
Herb list :
Red pepper - Capsicum annuum - فلفل قرمز
Refrences & Litretures:
544. Journal:'International Journal of Food Properties' Year:'2013' Volume:'16' Page:'18' DOI:'10.1080/10942912.2010.513616' Title:'Pakistani Bell Pepper (Capsicum annum L.): Chemical Compositions and its Antioxidant Activity'
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