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| Chrome Azurol S |
| C.I. 43825 |
| Mordant Blue 29 |
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Predict NMR spectrum
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| InChI: |
1S/C23H16Cl2O9S.3Na/c1-9-5-11(7-13(20(9)26)22(28)29)17(12-6-10(2)21(27)14(8-12)23(30)31)18-15(24)3-4-16(19(18)25)35(32,33)34;;;/h3-8,26H,1-2H3,(H,28,29)(H,30,31)(H,32,33,34);;;/q;3*+1/p-3/b17-12+;;; |
| InChIKey: |
FUIZKNBTOOKONL-DPSBJRLESA-K |
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| H donor: |
1 |
| H acceptor: |
9 |
| Rotatable bond: |
5 |
| Stereocenter: |
0 |
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| cLogP: |
2.444 |
| cLogS: |
-3.807 |
| Polar surface: |
183.14 |
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