Formula |
C17H15ClFNO3 |
IUPAC Name |
4-[[(z)-(4-chlorophenyl)-(3-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]butanoic acid |
Molecular Mass |
335.757 g·mol−1 |
Heat of Formation |
-582.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.03 ± 1.08 D |
Volume |
378.19 Å 3 |
Surface Area |
337.89 Å 2 |
HOMO Energy |
-8.45 ± 0.55 eV |
LUMO Energy |
1.93 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-[[(4-chlorophenyl)-(3-fluoro-6-keto-1-cyclohexa-2,4-dienylidene)methyl]amino]butyric acid
- 4-[[(4-chlorophenyl)-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]butanoic acid
- 4-[[(z)-(4-chlorophenyl)-(3-fluoro-6-keto-1-cyclohexa-2,4-dienylidene)methyl]amino]butyric acid
- 4-[[(z)-(4-chlorophenyl)-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]butanoic acid
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InChIKey |
AJPSGLKFKRSEBJ-VKAVYKQESA-N |
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Links |
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DOI |
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Downloads |
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Elements |
C
F
H
Cl
O
N
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