Rhoduline Acid structure

Rhoduline Acid

4-hydroxy-7-[(5-hydroxy-7-sulfonaphthalen-2-yl)amino]naphthalene-2-sulfonic acid

CAS: 87-03-6
Molecular Formula C20H15NO8S2
Molecular Weight 461.5 g/mol
LogP 2.7
Topological Polar Surface Area 178.0 A2
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 9
Rotatable Bonds 4
Exact Mass 461.0239
Heavy Atoms 31
Complexity 781.0

Chemical Identifiers

CAS Number 87-03-6
SMILES C1=CC2=C(C=C(C=C2C=C1NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)O)S(=O)(=O)O)O
InChIKey BQVLLTHCZQAJNH-UHFFFAOYSA-N

📖 Product Overview

Rhoduline Acid (CAS: 87-03-6) is a chemical compound with molecular formula C20H15NO8S2 and molecular weight 461.5 g/mol. Its IUPAC systematic name is 4-hydroxy-7-[(5-hydroxy-7-sulfonaphthalen-2-yl)amino]naphthalene-2-sulfonic acid. LogP 2.7 Topological Polar Surface Area 178.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 9 Rotatable Bonds 4 Exact Mass 461.0239 Heavy Atoms 31 Complexity 781.0 InChI Key: BQVLLTHCZQAJNH-UHFFFAOYSA-N. SMILES: C1=CC2=C(C=C(C=C2C=C1NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)O)S(=O)(=O)O)O.

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