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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
2,2,4a-trimethyl-8-methylene-2a,3,4,5,6,7-hexahydro-1H-cyclobuta[i]indene , 2,2,4a-trimethyl-8-methylidene-2a,3,4,5,6,7-hexahydro-1H-cyclobuta[i]indene , 2,2,4a-trimethyl-8-methylene-2a,3,4,5,6,7-hexahydro-1H-cyclobut[i]indene
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| Smiles: |
C=C1CCC[C@]2([C@]31CC([C@@H]3CC2)(C)C)C
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| InChi : |
InChI=1S/C15H24/c1-11-6-5-8-14(4)9-7-12-13(2,3)10-15(11,12)14/h12H,1,5-10H2,2-4H3/t12-,14+,15-/m0/s1
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| InChi Key : |
InChIKey=LTMKWDWWHXRNMO-CFVMTHIKSA-N
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| PubChem ID : |
595133
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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 : |
9.388975
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
0.849
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| XLogP : |
6.546
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VDW volume : |
228.290393
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| Molecular weight : |
204.187801
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HOMO-LUMO gap : |
10.686000
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| Herb list : |
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| Refrences & Litretures: |
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