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Naphthalene,1,2-dihydro-1,5,8-trimethyl
PHCD compound ID : 4027
Chemical Names :
Naphthalene,1,2-dihydro-1,5,8-trimethyl
Molecular Formula : C13H16
Molecular Weight : 172.125201
More Details :
Names & Synonyms: 1,5,8-trimethyl-1,2-dihydronaphthalene
Smiles: C[C@H]1CC=Cc2c1c(C)ccc2C
InChi : InChI=1S/C13H16/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h4,6-8,10H,5H2,1-3H3/t10-/m0/s1
InChi Key : InChIKey=YJFOZRTWRVNHOG-JTQLQIEISA-N
PubChem ID : 20595
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.625333
Hydrogen bond donor count : 0 Electric dipole moment : 0.781
XLogP : 4.591 VDW volume : 187.245507
Molecular weight : 172.125201 HOMO-LUMO gap : 8.717000
Herb list :
Refrences & Litretures:
  
556.      Journal:'Int. J. Agri. Biol'      Year:'2006'      Volume:'8'      Page:'8530'      DOI:''      Title:'Essential Oils of Qare-Qat (Vaccinium arctostaphylos) Shoots and Chemical Composition of Berries'
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