EINECS 201-687-1

7-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]naphthalene-1,3-disulfonic acid

CAS: 86-63-5

Molecular Formula	`C18H17N3O7S2`
Molecular Weight	451.5 g/mol
LogP	2.1
Topological Polar Surface Area	185.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	10
Rotatable Bonds	5
Exact Mass	451.05078
Heavy Atoms	30
Complexity	837.0

Chemical Identifiers

CAS Number	86-63-5
SMILES	`CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N`
InChIKey	`JLVALQOIIVGPBD-UHFFFAOYSA-N`

📖 Product Overview

EINECS 201-687-1 (CAS: 86-63-5) is a chemical compound with molecular formula C18H17N3O7S2 and molecular weight 451.5 g/mol. Its IUPAC systematic name is 7-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]naphthalene-1,3-disulfonic acid. LogP 2.1 Topological Polar Surface Area 185.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 10 Rotatable Bonds 5 Exact Mass 451.05078 Heavy Atoms 30 Complexity 837.0 InChI Key: JLVALQOIIVGPBD-UHFFFAOYSA-N. SMILES: CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N.

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