Common name
nitrothal-isopropyl
Formula
C14H17NO6
CAS
10552-74-6
IUPAC name
1,3-bis(1-methylethyl) 5-nitro-1,3-benzenedicarboxylate
SMILES
CC(C)OC(=O)c1cc(cc(c1)N(=O)=O)C(=O)OC(C)C
INCHI
InChI=1S/C14H17NO6/c1-8(2)20-13(16)10-5-11(14(17)21-9(3)4)7-12(6-10)15(18)19/h5-9H,1-4H3
Physicochemical Properties
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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: 7
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AgroPAD
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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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