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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
2,2,3,3,4,4,4-heptafluorobutanoic acid , 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoic acid , 2,2,3,3,4,4,4-heptafluorobutyric acid
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| Smiles: |
OC(=O)C(C(C(F)(F)F)(F)F)(F)F
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| InChi : |
InChI=1S/C4HF7O2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H,12,13)
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| InChi Key : |
InChIKey=YPJUNDFVDDCYIH-UHFFFAOYSA-N
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| PubChem ID : |
9777
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| Rotatable bond count : |
3
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
2
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Ionization potential : |
12.195678
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| Hydrogen bond donor count : |
1
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Electric dipole moment : |
2.070
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| XLogP : |
2.381
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VDW volume : |
135.157304
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| Molecular weight : |
213.986477
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HOMO-LUMO gap : |
11.558000
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| Herb list : |
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| Refrences & Litretures: |
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