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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
7-isopropenyl-1,8a-dimethyl-2,3,7,8-tetrahydro-1H-naphthalene , 1,8a-dimethyl-7-(1-methylethenyl)-2,3,7,8-tetrahydro-1H-naphthalene , 1,8a-dimethyl-7-prop-1-en-2-yl-2,3,7,8-tetrahydro-1H-naphthalene
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| Smiles: |
CC(=C)[C@@H]1C=CC2=CCC[C@H]([C@@]2(C1)C)C
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| InChi : |
InChI=1S/C15H22/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7-9,12-13H,1,5-6,10H2,2-4H3/t12-,13-,15+/m1/s1
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| InChi Key : |
InChIKey=DQPQHEZYSQLQOQ-NFAWXSAZSA-N
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| PubChem ID : |
91710361
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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 : |
8.713423
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
1.212
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| XLogP : |
5.842
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VDW volume : |
235.373935
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| Molecular weight : |
202.172151
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HOMO-LUMO gap : |
9.198000
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| Herb list : |
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| Refrences & Litretures: |
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