(2E)-1,1,1-Trifluoro-4-Oxo-4-Phenyl-2-Buten-2-Yl 4-(Methylsulfanyl)Benzoate
Properties
Property | Value |
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Formula | C18H13F3O3S |
IUPAC Name | [(e)-3-oxo-3-phenyl-1-(trifluoromethyl)prop-1-enyl] 4-methylsulfanylbenzoate |
Molecular Mass | 366.354 g·mol−1 |
Heat of Formation | -865.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.54 ± 1.08 D |
Volume | 391.72 Å 3 |
Surface Area | 355.76 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | 1.72 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | FYOXXDMISXLCKD-LFIBNONCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O F |