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aniline black

Structure via PubChem · Public domain (PubChem)

EntityQ413995· pop 8

aniline black

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Also known as C.I. Pigment Black 1

chemical compound

Chemical data

Formula
C66H51Cr3N11O12
Molecular weight
1346.2 g/mol
IUPAC name
2-N-[8-[[8-(4-aminoanilino)-10-phenylphenazin-10-ium-2-yl]amino]-10-phenylphenazin-10-ium-2-yl]-8-N,10-diphenylphenazin-10-ium-2,8-diamine;tris(hydroxy-oxido-dioxochromium)
SMILES
C1=CC=C(C=C1)NC2=CC3=C(C=C2)N=C4C=CC(=CC4=[N+]3C5=CC=CC=C5)NC6=CC7=C(C=C6)N=C8C=CC(=CC8=[N+]7C9=CC=CC=C9)NC1=CC2=[N+](C3=C(C=CC(=C3)NC3=CC=C(C=C3)N)N=C2C=C1)C1=CC=CC=C1.O[Cr](=O)(=O)[O-].O[Cr](=O)(=O)[O-].O[Cr](=O)(=O)[O-]
InChIKey
FWLHAQYOFMQTHQ-UHFFFAOYSA-N
Polar surface area
357 Ų
H-bond donors
8
H-bond acceptors
20
Formal charge
0

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