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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
1-allyl-2,3,4,5-tetramethoxy-benzene , 1,2,3,4-tetramethoxy-5-prop-2-enylbenzene , 1,2,3,4-tetramethoxy-5-prop-2-enyl-benzene
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| Smiles: |
C=CCc1cc(OC)c(c(c1OC)OC)OC
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| InChi : |
InChI=1S/C13H18O4/c1-6-7-9-8-10(14-2)12(16-4)13(17-5)11(9)15-3/h6,8H,1,7H2,2-5H3
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| InChi Key : |
InChIKey=HRAXJWRHSUTMCS-UHFFFAOYSA-N
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| PubChem ID : |
617233
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| Rotatable bond count : |
6
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
4
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Ionization potential : |
8.423874
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
2.099
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| XLogP : |
2.813
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VDW volume : |
234.762872
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| Molecular weight : |
238.120509
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HOMO-LUMO gap : |
8.511000
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| Herb list : |
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| Refrences & Litretures: |
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