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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
4-isopropyl-1,6-dimethylene-decalin , 4,7-dimethylene-1-propan-2-yl-1,2,3,4a,5,6,8,8a-octahydronaphthalene , 4,7-dimethylidene-1-propan-2-yl-1,2,3,4a,5,6,8,8a-octahydronaphthalene
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| Smiles: |
C=C1CC[C@@H]2[C@H](C1)[C@@H](CCC2=C)C(C)C
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| InChi : |
InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h10,13-15H,3-9H2,1-2H3/t13-,14-,15+/m0/s1
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| InChi Key : |
InChIKey=NOLWRMQDWRAODO-SOUVJXGZSA-N
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| PubChem ID : |
520461
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| Rotatable bond count : |
1
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Rule of five : |
1
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| Hydrogen bond acceptor count : |
0
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Ionization potential : |
9.462440
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
1.312
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| XLogP : |
5.991
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VDW volume : |
238.010393
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| Molecular weight : |
204.187801
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HOMO-LUMO gap : |
10.758000
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| Herb list : |
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| Refrences & Litretures: |
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