Molecule structure of 2,4-Dichlorobenzenediazonium 1,5-naphthalenedisulfonate hydrate (CAS NO.123333-91-5):
Systematic Name: 2,4-Dichlorobenzenediazonium 5-sulfonaphthalene-1-sulfonate hydrate
Molecular Formula: C6Cl2H3N2.C10H7O6S2.H2O
Molecular Weight: 479.31 g/mol
CAS Registry Number: 123333-91-5
SMILES: N#[N+]c1ccc(Cl)cc1Cl.[O-]S(=O)(=O)c1cccc2c1cccc2S(=O)(=O)O.O
InChI: InChI=1/C10H8O6S2.C6H3Cl2N2.H2O/c11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16;7-4-1-2-6(10-9)5(8)3-4;/h1-6H,(H,11,12,13)(H,14,15,16);1-3H;1H2/q;+1;/p-1
InChIKey: SPGAUZWLXGQOLT-REWHXWOFAF
Std. InChI: InChI=1S/C10H8O6S2.C6H3Cl2N2.H2O/c11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16;7-4-1-2-6(10-9)5(8)3-4;/h1-6H,(H,11,12,13)(H,14,15,16);1-3H;1H2/q;+1;/p-1
Std. InChIKey of 2,4-Dichlorobenzenediazonium 1,5-naphthalenedisulfonate hydrate (CAS NO.123333-91-5): SPGAUZWLXGQOLT-UHFFFAOYSA-M
RIDADR: 1759
HazardClass: 8
PackingGroup: III
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