benzamorf

Identification (Source:EPA,EU)

ID 639
Name benzamorf
CAS 12068-08-5
IUPAC morpholinium 4-dodecylbenzenesulfonate
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
CIPAC
EPA Code
Formula C22H39NO4S
SMILES S(c(c([H])c([H])c1C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])c([H])c1[H])(=O)(=O)O[H].O2C([H])([H])C([H])([H])N([H])C([H])([H])C2([H])[H]
Status Not Available

Classification

Mode of Action
Pesticide Type
Chemical Group
Classification morpholine fungicides

Properties (Source:PubChem)

Molecular Weight 413.61436
Physical State
AlogP 6.139
H-Bond Donor 2
H-Bond Acceptor 5
Surface Area 427.04
Polar Surface Area 84.01

Structure



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2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


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