Formula |
C28H22Cl3NO4 |
IUPAC Name |
3-[(e)-2-[2-chloro-4-[[3-(2,6-dichlorophenyl)-5-isopropyl-isoxazol-4-yl]methoxy]phenyl]vinyl]benzoic acid |
Molecular Mass |
542.838 g·mol−1 |
Heat of Formation |
-345.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.93 ± 1.08 D |
Volume |
594.21 Å 3 |
Surface Area |
459.37 Å 2 |
HOMO Energy |
-9.21 ± 0.55 eV |
LUMO Energy |
2.12 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-[(e)-2-[2-chloro-4-[[3-(2,6-dichlorophenyl)-5-isopropyl-4-isoxazolyl]methoxy]phenyl]vinyl]benzoic acid
- 3-[(e)-2-[2-chloro-4-[[3-(2,6-dichlorophenyl)-5-isopropyl-isoxazol-4-yl]methoxy]phenyl]vinyl]benzoic acid
- 3-[(e)-2-[2-chloro-4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]methoxy]phenyl]ethenyl]benzoic acid
- gw 4064
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CAS Number(s) |
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InChIKey |
BYTNEISLBIENSA-MDZDMXLPSA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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