Formula |
C9H9FO4 |
IUPAC Name |
2-(2-fluoro-4-hydroxy-5-methoxy-phenyl)acetic acid |
Molecular Mass |
200.164 g·mol−1 |
Heat of Formation |
-828.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.27 ± 1.08 D |
Volume |
222.36 Å 3 |
Surface Area |
214.16 Å 2 |
HOMO Energy |
-9.33 ± 0.55 eV |
LUMO Energy |
-0.45 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-(2-fluoro-4-hydroxy-5-methoxy-phenyl)ethanoic acid
- 2-(2-fluoro-4-hydroxy-5-methoxyphenyl)acetic acid
- 6-flhva
- 6-fluoro-homovanillic acid
- 6-fluorohomovanillic acid
- benzenacetic acid, 2-fluoro-4-hydroxy-5-methoxy-
- benzeneacetic acid, 2-(fluoro-18f)-4-hydroxy-5-methoxy-
- benzeneacetic acid, 2-fluoro-4-hydroxy-5-methoxy-
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CAS Number(s) |
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InChIKey |
JPDCBZYVMUTEFB-UHFFFAOYSA-N |
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Links |
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DOI |
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Elements |
H
C
O
F
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