Responsive image

Common name


ethoxyfen

IUPAC name


(1S)-1-carboxyethyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate

SMILES


C[C@@H](C(=O)O)OC(=O)c1cc(ccc1Cl)Oc1ccc(cc1Cl)C(F)(F)F

Compound class


Herbicide

Therapeutic area


Herbicide

Common name


ethoxyfen

IUPAC name


(1S)-1-carboxyethyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate

SMILES


C[C@@H](C(=O)O)OC(=O)c1cc(ccc1Cl)Oc1ccc(cc1Cl)C(F)(F)F

INCHI


InChI=1S/C17H11Cl2F3O5/c1-8(15(23)24)26-16(25)11-7-10(3-4-12(11)18)27-14-5-2-9(6-13(14)19)17(20,21)22/h2-8H,1H3,(H,23,24)/t8-/m0/s1

FORMULA


C17H11Cl2F3O5

Responsive image

Common name


ethoxyfen

IUPAC name


(1S)-1-carboxyethyl 2-chloro-5-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate

Molecular weight


423.167

clogP


4.867

clogS


-5.265

HBond Acceptor


5

HBond Donor


1

Total Polar
Surface Area


72.83

Number of Rings


2

Rotatable Bond


7

Drug ID Common name Structure CAS SMILE Frequency
FDBF00016 chlorobenzene Responsive image c1ccc(cc1)Cl 0.0718
FDBF00177 fluoroform Responsive image FC(F)F 0.0704
FDBF01437 4-chlorophenol Responsive image Oc1ccc(cc1)Cl 0.0072
FDBF02866 2-chlorophenol Responsive image Clc1ccccc1O 0.0055
4 , 1