Formula |
C21H19ClO3 |
IUPAC Name |
(5z)-3-benzyl-5-[(3-chloro-4-hydroxy-phenyl)methylene]-4-isopropyl-furan-2-one |
Molecular Mass |
354.827 g·mol−1 |
Heat of Formation |
-300.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.15 ± 1.08 D |
Volume |
417.38 Å 3 |
Surface Area |
358.37 Å 2 |
HOMO Energy |
-8.81 ± 0.55 eV |
LUMO Energy |
-1.31 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (5z)-3-(benzyl)-5-(3-chloro-4-hydroxy-benzylidene)-4-isopropyl-furan-2-one
- (5z)-5-[(3-chloro-4-hydroxy-phenyl)methylene]-4-isopropyl-3-(phenylmethyl)furan-2-one
- (5z)-5-[(3-chloro-4-hydroxy-phenyl)methylidene]-3-(phenylmethyl)-4-propan-2-yl-furan-2-one
- (5z)-5-[(3-chloro-4-hydroxyphenyl)methylene]-4-isopropyl-3-(phenylmethyl)-2-furanone
- (5z)-5-[(3-chloro-4-hydroxyphenyl)methylidene]-3-(phenylmethyl)-4-propan-2-ylfuran-2-one
- 3-(benzyl)-5-(3-chloro-4-hydroxy-benzylidene)-4-isopropyl-furan-2-one
- 5-[(3-chloro-4-hydroxy-phenyl)methylene]-4-isopropyl-3-(phenylmethyl)furan-2-one
- 5-[(3-chloro-4-hydroxy-phenyl)methylidene]-3-(phenylmethyl)-4-propan-2-yl-furan-2-one
- 5-[(3-chloro-4-hydroxyphenyl)methylene]-4-isopropyl-3-(phenylmethyl)-2-furanone
- 5-[(3-chloro-4-hydroxyphenyl)methylidene]-3-(phenylmethyl)-4-propan-2-ylfuran-2-one
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InChIKey |
FJCMKDBQNWQPBT-UNOMPAQXSA-N |
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Links |
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Elements |
H
C
O
Cl
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