IUPAC name
N1,N1-diethyl-2,6-dinitro-4-(trifluoromethyl)-1,3-benzenediamine
SMILES
CCN(CC)c1c(cc(c(c1N(=O)=O)N)C(F)(F)F)N(=O)=O
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
dinitramine
IUPAC name
N1,N1-diethyl-2,6-dinitro-4-(trifluoromethyl)-1,3-benzenediamine
SMILES
CCN(CC)c1c(cc(c(c1N(=O)=O)N)C(F)(F)F)N(=O)=O
INCHI
InChI=1S/C11H13F3N4O4/c1-3-16(4-2)9-7(17(19)20)5-6(11(12,13)14)8(15)10(9)18(21)22/h5H,3-4,15H2,1-2H3
FORMULA
C11H13F3N4O4
Common name
dinitramine
IUPAC name
N1,N1-diethyl-2,6-dinitro-4-(trifluoromethyl)-1,3-benzenediamine
Molecular weight
322.241
clogP
-0.854
clogS
-3.391
HBond Acceptor
7
HBond Donor
2
Total Polar Surface Area
97.54
Number of Rings
1
Rotatable Bond
6
