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ScientificNameLabel
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4,11,11-Trimethyl-8-methylene-,[1R-(1R*,4Z,9S*)]-bicyclo[7.2.0]undec-4-ene
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| PHCD compound ID : |
2690
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| Chemical Names : |
4,11,11-Trimethyl-8-methylene-,[1R-(1R*,4Z,9S*)]-bicyclo[7.2.0]undec-4-ene
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| Molecular Formula : |
C15H24
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| Molecular Weight : |
204.187801
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More Details :
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| Names & Synonyms: |
(1S,4Z,9R)-4,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-ene , (1S,4Z,9R)-4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene , (1S,4Z,9R)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene , (1S,4Z,9R)-4,11,11-trimethyl-8-methylidene-bicyclo[7.2.0]undec-4-ene
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| Smiles: |
CC1=CCCC(=C)[C@H]2[C@H](CC1)C(C2)(C)C
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| InChi : |
InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-/t13-,14-/m0/s1
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| InChi Key : |
InChIKey=NPNUFJAVOOONJE-BJLYVFBQSA-N
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| PubChem ID : |
5452236
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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 : |
9.173232
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
1.329
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| XLogP : |
6.044
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VDW volume : |
238.010393
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| Molecular weight : |
204.187801
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HOMO-LUMO gap : |
10.391000
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| Herb list : |
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| Refrences & Litretures: |
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