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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(4aR,8aR)-3-isopropylidene-5,8a-dimethyl-1,2,4,4a,7,8-hexahydronaphthalene , (4aR,8aR)-5,8a-dimethyl-3-propan-2-ylidene-1,2,4,4a,7,8-hexahydronaphthalene
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| Smiles: |
CC1=CCC[C@]2([C@H]1CC(=C(C)C)CC2)C
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| InChi : |
InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,14H,5,7-10H2,1-4H3/t14-,15+/m0/s1
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| InChi Key : |
InChIKey=WNRBYZQFEBIUGD-LSDHHAIUSA-N
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| PubChem ID : |
6432648
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| Rotatable bond count : |
0
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Rule of five : |
1
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| Hydrogen bond acceptor count : |
0
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Ionization potential : |
8.801496
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
0.442
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| XLogP : |
5.553
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VDW volume : |
238.010393
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| Molecular weight : |
204.187801
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HOMO-LUMO gap : |
10.239000
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| Herb list : |
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| Refrences & Litretures: |
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