EINECS 228-364-8

4-(4-acetamidoanilino)-1-amino-9,10-dioxoanthracene-2-sulfonic acid

CAS: 6247-34-3

Molecular Formula	`C22H17N3O6S`
Molecular Weight	451.5 g/mol
LogP	2.8
Topological Polar Surface Area	164.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	8
Rotatable Bonds	4
Exact Mass	451.0838
Heavy Atoms	32
Complexity	863.0

Chemical Identifiers

CAS Number	6247-34-3
SMILES	`CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O`
InChIKey	`CKDSSRXGNPFPPZ-UHFFFAOYSA-N`

📖 Product Overview

EINECS 228-364-8 (CAS: 6247-34-3) is a chemical compound with molecular formula C22H17N3O6S and molecular weight 451.5 g/mol. Its IUPAC systematic name is 4-(4-acetamidoanilino)-1-amino-9,10-dioxoanthracene-2-sulfonic acid. LogP 2.8 Topological Polar Surface Area 164.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 8 Rotatable Bonds 4 Exact Mass 451.0838 Heavy Atoms 32 Complexity 863.0 InChI Key: CKDSSRXGNPFPPZ-UHFFFAOYSA-N. SMILES: CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.

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