| Formula |
C20H17Br2N3O5 |
| IUPAC Name |
(2s)-2-amino-3-[3,5-dibromo-4-[4-hydroxy-3-[(6-oxo-1h-pyridazin-3-yl)methyl]phenoxy]phenyl]propanoic acid |
| Molecular Mass |
539.174 g·mol−1 |
| Heat of Formation |
-474.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
0.98 ± 1.08 D |
| Volume |
504.21 Å 3 |
| Surface Area |
397.47 Å 2 |
| HOMO Energy |
-8.88 ± 0.55 eV |
| LUMO Energy |
-0.90 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2s)-2-amino-3-[3,5-dibromo-4-[4-hydroxy-3-[(6-keto-1h-pyridazin-3-yl)methyl]phenoxy]phenyl]propionic acid
- (2s)-2-amino-3-[3,5-dibromo-4-[4-hydroxy-3-[(6-oxo-1h-pyridazin-3-yl)methyl]phenoxy]phenyl]propanoic acid
|
| InChIKey |
BPCRJQJRJFLQHV-INIZCTEOSA-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
Br
N
|
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