Common name
benzamorf
Formula
C22H39NO4S
CAS
12068-08-5
IUPAC name
4-dodecylbenzenesulfonic acid compound with morpholine (1:1)
SMILES
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)O.C1COCCN1
INCHI
InChI=1S/C18H30O3S.C4H9NO/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;1-3-6-4-2-5-1/h13-16H,2-12H2,1H3,(H,19,20,21);5H,1-4H2
Physicochemical Properties
Molecular weight:
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Complexity of system:
Lipophilicity
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Water Solubility
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Geometric
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Electrostatic
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Flexibility
Num. Rot. bonds: 12
Frac. of Rot. bonds:
AgroPAD
Photostability
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Topological
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Fungicide-likeness scores
The higher the score, the better the fungicide-likeness
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