calcium bis(2-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate)

CAS: 1103-39-5

Molecular Formula	`C40H26CaN4O8S2`
Molecular Weight	794.9 g/mol
Topological Polar Surface Area	221.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	12
Rotatable Bonds	4
Exact Mass	794.0818
Heavy Atoms	55
Complexity	634.0

Chemical Identifiers

CAS Number	1103-39-5
SMILES	`C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])O.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])O.[Ca+2]`
InChIKey	`UETSCOQSVNUXDH-UHFFFAOYSA-L`

📖 Product Overview

calcium bis(2-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate) (CAS: 1103-39-5) is a chemical compound with molecular formula C40H26CaN4O8S2 and molecular weight 794.9 g/mol. Its IUPAC systematic name is calcium bis(2-[(2-hydroxynaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate). Topological Polar Surface Area 221.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 12 Rotatable Bonds 4 Exact Mass 794.0818 Heavy Atoms 55 Complexity 634.0 InChI Key: UETSCOQSVNUXDH-UHFFFAOYSA-L. SMILES: C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])O.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])O.[Ca+2].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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