In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 18 | No |
Popular Name: Ethyl 3-(3-chloro-2,4,5-trifluorophenyl)-3-oxopropanoate Ethyl 3-(3-chloro-2,4,5-trifluor…
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CAS Number: 101987-86-4
Benzenepropanoic acid,3-chloro-2,4,5-trifluoro-b-oxo-, ethyl ester
Ethyl 3-chloro-2,4,5-tri-fluorobenzoyl acetate
Ethyl 3-chloro-2,4,5-trifluorobenzoylacetate
ethyl beta-(3-chloro-2,4,5-trifluorophenyl)-beta-oxopropionate
ethyl-3-(3-CHLORO-2,4,5-TRIFLUOROPHENYL)-3-OXOPROPANOATE
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.61 | 8.27 | -16.69 | 0 | 3 | 0 | 43 | 280.629 | 5 | ↓ |
Note Type | Comments | Provided By |
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Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.