Formula |
C24H23F3N2O5 |
IUPAC Name |
2-[5-[3-[[7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propoxy]-4h-indol-1-ium-4-id-1-yl]acetic acid |
Molecular Mass |
476.445 g·mol−1 |
Heat of Formation |
-1067.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.10 ± 1.08 D |
Volume |
531.57 Å 3 |
Surface Area |
473.92 Å 2 |
HOMO Energy |
-8.46 ± 0.55 eV |
LUMO Energy |
1.92 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[5-[3-[7-propyl-3-(trifluoromethyl)indoxazen-6-yl]oxypropoxy]indol-1-yl]acetic acid
- 2-[5-[3-[[7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propoxy]-1-indolyl]acetic acid
- 2-[5-[3-[[7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propoxy]indol-1-yl]acetic acid
- 2-[5-[3-[[7-propyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]propoxy]indol-1-yl]ethanoic acid
- 2-{5-[3-(7-propyl-3-trifluoromethylbenzo[d]isoxazol-6-yloxy)propoxy]indol-1-yl}ethanoic acid
- 3ea
- bpr-1h-036
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InChIKey |
TWVYNPULGKGJOS-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
F
O
N
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