Formula |
C12H9NO3 |
IUPAC Name |
7-hydroxy-4,8-dimethyl-2-oxo-chromene-6-carbonitrile |
Molecular Mass |
215.205 g·mol−1 |
Heat of Formation |
-294.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.58 ± 1.08 D |
Volume |
244.67 Å 3 |
Surface Area |
232.95 Å 2 |
HOMO Energy |
-9.72 ± 0.55 eV |
LUMO Energy |
-1.36 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 6-cyano-7-hydroxy-4,8-dimethylcoumarin
- 7-hydroxy-2-keto-4,8-dimethyl-chromene-6-carbonitrile
- 7-hydroxy-4,8-dimethyl-2-oxo-6-chromenecarbonitrile
- 7-hydroxy-4,8-dimethyl-2-oxochromene-6-carbonitrile
- chdmc
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CAS Number(s) |
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InChIKey |
XAZQZKKQXOIMAO-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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