Formula |
C24H29NO5 |
IUPAC Name |
2-[2-[2-[(2r)-4-hexyl-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid |
Molecular Mass |
411.491 g·mol−1 |
Heat of Formation |
-840.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.24 ± 1.08 D |
Volume |
503.37 Å 3 |
Surface Area |
374.65 Å 2 |
HOMO Energy |
-8.55 ± 0.55 eV |
LUMO Energy |
-0.10 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[2-[2-[(2r)-4-hexyl-3-keto-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid
- 2-[2-[2-[(2r)-4-hexyl-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid
- 2-[2-[2-[(2r)-4-hexyl-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethanoic acid
- rwj-348260
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InChIKey |
IAZPXLCQCRLWJX-JOCHJYFZSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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