1-amino-2-methyl-4-(4-methylanilino)anthracene-9,10-dione

CAS: 116-77-8

Molecular Formula	`C22H18N2O2`
Molecular Weight	342.4 g/mol
LogP	5.6
Topological Polar Surface Area	72.2 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	342.13684
Heavy Atoms	26
Complexity	554.0

Chemical Identifiers

CAS Number	116-77-8
SMILES	`CC1=CC=C(C=C1)NC2=C3C(=C(C(=C2)C)N)C(=O)C4=CC=CC=C4C3=O`
InChIKey	`BYGSHXHLDPUXIF-UHFFFAOYSA-N`

📖 Product Overview

1-amino-2-methyl-4-(4-methylanilino)anthracene-9,10-dione (CAS: 116-77-8) is a chemical compound with molecular formula C22H18N2O2 and molecular weight 342.4 g/mol. Its IUPAC systematic name is 1-amino-2-methyl-4-(4-methylanilino)anthracene-9,10-dione. LogP 5.6 Topological Polar Surface Area 72.2 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 342.13684 Heavy Atoms 26 Complexity 554.0 InChI Key: BYGSHXHLDPUXIF-UHFFFAOYSA-N. SMILES: CC1=CC=C(C=C1)NC2=C3C(=C(C(=C2)C)N)C(=O)C4=CC=CC=C4C3=O.

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