12217-86-6 Purity
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Specification
The molecular formula of Disperse Black 9 is C16H20N4O2.
The molecular weight of Disperse Black 9 is 300.36 g/mol.
The IUPAC name of Disperse Black 9 is 2-[4-[(4-aminophenyl)diazenyl]-N-(2-hydroxyethyl)anilino]ethanol.
The InChIKey of Disperse Black 9 is NZKTVPCPQIEVQT-UHFFFAOYSA-N.
The canonical SMILES of Disperse Black 9 is C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)N(CCO)CCO.
The CAS number of Disperse Black 9 is 20721-50-0.
The UNII of Disperse Black 9 is 7GKC99M24T.
The XLogP3-AA value of Disperse Black 9 is 1.8.
Disperse Black 9 has 3 hydrogen bond donor counts.
Disperse Black 9 has 7 rotatable bond counts.
The InChI of Disperse Black 9 is InChI=1S/C16H20N4O2/c17-13-1-3-14(4-2-13)18-19-15-5-7-16(8-6-15)20(9-11-21)10-12-22/h1-8,21-22H,9-12,17H2.
The XLogP3-AA of Disperse Black 9 is 1.8.
The hydrogen bond donor count of Disperse Black 9 is 3.
The Topological Polar Surface Area of Disperse Black 9 is 94.4 ?2.