1A-4B-20A [Russian]

1-amino-4-benzoyl-9,10-dioxoanthracene-2-sulfonic acid

CAS: 65894-78-2

Molecular Formula	`C21H13NO6S`
Molecular Weight	407.4 g/mol
LogP	2.8
Topological Polar Surface Area	140.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	3
Exact Mass	407.04636
Heavy Atoms	29
Complexity	796.0

Chemical Identifiers

CAS Number	65894-78-2
SMILES	`C1=CC=C(C=C1)C(=O)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O`
InChIKey	`KXHYQFMBZVSEIX-UHFFFAOYSA-N`

📖 Product Overview

1A-4B-20A [Russian] (CAS: 65894-78-2) is a chemical compound with molecular formula C21H13NO6S and molecular weight 407.4 g/mol. Its IUPAC systematic name is 1-amino-4-benzoyl-9,10-dioxoanthracene-2-sulfonic acid. LogP 2.8 Topological Polar Surface Area 140.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 3 Exact Mass 407.04636 Heavy Atoms 29 Complexity 796.0 InChI Key: KXHYQFMBZVSEIX-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.

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