Compound C18H14N2Na2O8S2

disodium;4-hydroxy-3-[(2-methoxy-5-methylphenyl)diazenyl]naphthalene-2,6-disulfonate

CAS: 5864-85-7

Molecular Formula	`C18H14N2Na2O8S2`
Molecular Weight	496.4 g/mol
Topological Polar Surface Area	185.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	10
Rotatable Bonds	3
Exact Mass	495.9987
Heavy Atoms	32
Complexity	809.0

Chemical Identifiers

CAS Number	5864-85-7
SMILES	`CC1=CC(=C(C=C1)OC)N=NC2=C(C=C3C=CC(=CC3=C2O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]`
InChIKey	`LQHGEMMLQBEXDA-UHFFFAOYSA-L`

📖 Product Overview

Compound C18H14N2Na2O8S2 (CAS: 5864-85-7) is a chemical compound with molecular formula C18H14N2Na2O8S2 and molecular weight 496.4 g/mol. Its IUPAC systematic name is disodium;4-hydroxy-3-[(2-methoxy-5-methylphenyl)diazenyl]naphthalene-2,6-disulfonate. Topological Polar Surface Area 185.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 10 Rotatable Bonds 3 Exact Mass 495.9987 Heavy Atoms 32 Complexity 809.0 InChI Key: LQHGEMMLQBEXDA-UHFFFAOYSA-L. SMILES: CC1=CC(=C(C=C1)OC)N=NC2=C(C=C3C=CC(=CC3=C2O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].

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