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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(1R,2Z)-2,6,6-trimethyl-9-methylene-cycloundec-2-en-1-ol , (1R,2Z)-2,6,6-trimethyl-9-methylene-1-cycloundec-2-enol , (1R,2Z)-2,6,6-trimethyl-9-methylidenecycloundec-2-en-1-ol , (1R,2Z)-2,6,6-trimethyl-9-methylidene-cycloundec-2-en-1-ol
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| Smiles: |
C=C1CC[C@@H](O)C(=CCCC(CC1)(C)C)C
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| InChi : |
InChI=1S/C15H26O/c1-12-7-8-14(16)13(2)6-5-10-15(3,4)11-9-12/h6,14,16H,1,5,7-11H2,2-4H3/b13-6-/t14-/m1/s1
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| InChi Key : |
InChIKey=PAGSXLWQSGUSAH-CNTYAEFGSA-N
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| PubChem ID : |
6429042
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| Rotatable bond count : |
0
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
1
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Ionization potential : |
9.374316
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| Hydrogen bond donor count : |
1
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Electric dipole moment : |
1.634
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| XLogP : |
4.48
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VDW volume : |
259.157079
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| Molecular weight : |
222.198365
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HOMO-LUMO gap : |
10.446000
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| Herb list : |
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| Refrences & Litretures: |
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