2,6-bis[4-(diphenylamino) phenyl] -9,10-Anthracenedione

Catalog Number

ACM1640978331-1

CAS

1640978-33-1

Synonyms

AQ(PhDPA)2

IUPAC Name

2,6-bis[4-(N-phenylanilino)phenyl]anthracene-9,10-dione

Molecular Weight

694.82

Molecular Formula

C50H34N2O2

Canonical SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC5=C(C=C4)C(=O)C6=C(C5=O)C=CC(=C6)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C50H34N2O2/c53-49-46-32-26-38(36-23-29-44(30-24-36)52(41-17-9-3-10-18-41)42-19-11-4-12-20-42)34-48(46)50(54)45-31-25-37(33-47(45)49)35-21-27-43(28-22-35)51(39-13-5-1-6-14-39)40-15-7-2-8-16-40/h1-34H

InChI Key

NFOXDINRRDSYIP-UHFFFAOYSA-N

Purity

95%+

Density

1.258 ± 0.06 g/ml

• Catalog Number: ACM1640978331-1
• CAS: 1640978-33-1
• Synonyms: AQ(PhDPA)2
• IUPAC Name: 2,6-bis[4-(N-phenylanilino)phenyl]anthracene-9,10-dione
• Molecular Weight: 694.82
• Molecular Formula: C50H34N2O2
• Canonical SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC5=C(C=C4)C(=O)C6=C(C5=O)C=CC(=C6)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9
• InChI: InChI=1S/C50H34N2O2/c53-49-46-32-26-38(36-23-29-44(30-24-36)52(41-17-9-3-10-18-41)42-19-11-4-12-20-42)34-48(46)50(54)45-31-25-37(33-47(45)49)35-21-27-43(28-22-35)51(39-13-5-1-6-14-39)40-15-7-2-8-16-40/h1-34H
• InChI Key: NFOXDINRRDSYIP-UHFFFAOYSA-N
• Purity: 95%+
• Density: 1.258 ± 0.06 g/ml