| Formula |
C21H16FNO7 |
| IUPAC Name |
5-[2-fluoro-5-[(e)-3-(3-hydroxy-2-methoxycarbonyl-phenoxy)prop-1-enyl]phenyl]isoxazole-3-carboxylic acid |
| Molecular Mass |
413.353 g·mol−1 |
| Heat of Formation |
-897.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.02 ± 1.08 D |
| Volume |
446.86 Å 3 |
| Surface Area |
414.69 Å 2 |
| HOMO Energy |
-9.38 ± 0.55 eV |
| LUMO Energy |
1.79 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-[2-fluoro-5-[(e)-3-(3-hydroxy-2-methoxycarbonyl-phenoxy)prop-1-enyl]phenyl]-1,2-oxazole-3-carboxylic acid
- 5-[2-fluoro-5-[(e)-3-(3-hydroxy-2-methoxycarbonyl-phenoxy)prop-1-enyl]phenyl]isoxazole-3-carboxylic acid
- 5-[2-fluoro-5-[(e)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop-1-enyl]phenyl]-1,2-oxazole-3-carboxylic acid
- 5-[2-fluoro-5-[(e)-3-(3-hydroxy-2-methoxycarbonylphenoxy)prop-1-enyl]phenyl]-3-isoxazolecarboxylic acid
- 5-[5-[(e)-3-(2-carbomethoxy-3-hydroxy-phenoxy)prop-1-enyl]-2-fluoro-phenyl]isoxazole-3-carboxylic acid
- 5-{2-fluoro-5-[3-(3-hydroxy-2-methoxycarbonyl-phenoxy)-propenyl]-phenyl}-isoxazole-3-carboxylic acid
- compound 9
|
| InChIKey |
QKHWJUMLYAYZFS-ONEGZZNKSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
F
O
N
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