| Formula |
C21H20BrNO2 |
| IUPAC Name |
6-bromo-3-methyl-2-[4-[(1r)-1-methylpropyl]phenyl]quinoline-4-carboxylic acid |
| Molecular Mass |
398.293 g·mol−1 |
| Heat of Formation |
-171.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.09 ± 1.08 D |
| Volume |
425.22 Å 3 |
| Surface Area |
374.3 Å 2 |
| HOMO Energy |
-9.34 ± 0.55 eV |
| LUMO Energy |
1.64 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 6-bromo-2-[4-[(2r)-butan-2-yl]phenyl]-3-methyl-quinoline-4-carboxylic acid
- 6-bromo-2-[4-[(2r)-butan-2-yl]phenyl]-3-methylquinoline-4-carboxylic acid
|
| InChIKey |
YMJMVVCOCCXSSD-GFCCVEGCSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
Br
N
|
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