IUPAC name
N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitrobenzenamine
SMILES
CCC(CC)Nc1c(cc(C)c(C)c1N(=O)=O)N(=O)=O
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
pendimethalin
IUPAC name
N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitrobenzenamine
SMILES
CCC(CC)Nc1c(cc(C)c(C)c1N(=O)=O)N(=O)=O
INCHI
InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3
FORMULA
C13H19N3O4
Common name
pendimethalin
IUPAC name
N-(1-ethylpropyl)-3,4-dimethyl-2,6-dinitrobenzenamine
Molecular weight
281.308
clogP
0.333
clogS
-4.420
HBond Acceptor
6
HBond Donor
1
Total Polar Surface Area
80.31
Number of Rings
1
Rotatable Bond
6
