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Catalog No.:AA008OVQ
77501-63-4 | 2-ethoxy-1-methyl-2-oxoethyl 5-(2-chloro-4-trifluoromethylphenoxy)-2-nitrobenzoate
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Technical Information
Catalog Number:
AA008OVQ
Chemical Name:
2-ethoxy-1-methyl-2-oxoethyl 5-(2-chloro-4-trifluoromethylphenoxy)-2-nitrobenzoate
CAS Number:
77501-63-4
Molecular Formula:
C19H15ClF3NO7
Molecular Weight:
461.7731
MDL Number:
MFCD01632761
IUPAC Name:
(1-ethoxy-1-oxopropan-2-yl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate
InChI:
InChI=1S/C19H15ClF3NO7/c1-3-29-17(25)10(2)30-18(26)13-9-12(5-6-15(13)24(27)28)31-16-7-4-11(8-14(16)20)19(21,22)23/h4-10H,3H2,1-2H3
InChI Key:
CONWAEURSVPLRM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(OC(=O)c1cc(ccc1[N+](=O)[O-])Oc1ccc(cc1Cl)C(F)(F)F)C
EC Number:
616-466-9
UN Number:
3077
Properties
Computed Properties
 
Complexity:
657  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
461.049g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
461.774g/mol
Monoisotopic Mass:
461.049g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

Synonyms
 
1'-(carboethoxy)ethyl 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate 
lactofen 
EPA Pesticide Chemical Code 128888 
1'-(Carboethoxy)ethyl 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate 
83513-60-4 
DSSTox_CID_4160 
(+-)-2-Ethoxy-1-methyl-2-oxoethyl 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2 nitrobenzoate 
DSSTox_RID_77310 
DSSTox_GSID_24160 
Benzoic acid, 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitro-, 2-ethoxy-1-methyl-2-oxoethyl ester 
Benzoic acid, 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-, 2-ethoxy-1-methyl-2-oxoethyl ester 
UNII-L44N8UV47O 
LACTOFEN 
(1-ethoxy-1-oxopropan-2-yl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate 
5-(2-Chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoic acid 2-ethoxy-1-methyl-2-oxoethyl ester 
CAS-77501-63-4 
C19H15ClF3NO7 
Phoenix 
2-Ethoxy-1-methyl-2-oxoethyl 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate 
2-ethoxy-1-methyl-2-oxoethyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate 
L44N8UV47O 
5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic Acid 2-Ethoxy-1-methyl-2-oxoethyl ester 
Lactofen (>85%) 
77501-63-4 
AC1L1WSZ 
EC 616-466-9 
SCHEMBL39523 
AC1Q320S 
CHEMBL1243178 
DTXSID7024160 
CTK8E4014 
CONWAEURSVPLRM-UHFFFAOYSA-N 
Tox21_201300 
Tox21_300868 
Cobra 
AN-863 
MFCD01632761 
AKOS015902825 
(2-Ethoxy-1-methyl-2-oxoethyl)-5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate 
NCGC00164457-01 
NCGC00164457-02 
NCGC00164457-03 
NCGC00164457-04 
NCGC00254772-01 
NCGC00258852-01 
Cobra herbicide 
AC-12569 
CC-29812 
LS-36663 
SC-18169 
TR-024760 
FT-0619579 
Lactofen, PESTANAL(R), analytical standard 
X6746 
501L634 
I14-19704 
Lactofen [ANSI] 
(2-ethoxy-1-methyl-2-oxo-ethyl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate 
1-(carboethoxy)ethyl 5-[2-chloro-4-(trifluoromethyl)-phenoxy]-2-nitrobenzoate 
1-(carboethoxy)ethyl 5-[2-chloro-4-(trifluoromethyl)-phenoxyl]-2-nitrobenzoate 
1-(carboethoxy)ethyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate 
1-ethoxy-1-oxopropan-2-yl 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate 
Ethyl O-[5-(2-chloro-|A,|A,|A-trifluoro-p-tolyloxy)-2-nitrobenzoyl]-DL-lactate 
Lactofen (Cobra) 
CID62276 
C19-H15-Cl-F3-N-O7 
C055370 
PPG 844 
HSDB 6991 
2-Ethoxy-1-methyl-2-oxoethyl 5-(2-chloro-4-trifluoromethylphenoxy)-2-nitrobenzoate 
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