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63721-83-5

Name Xylenol Orange sodium salt
CAS 63721-83-5
EINECS(EC#) 216-553-8
Molecular Formula C31H31N2NaO13S
MDL Number MFCD00011493
Molecular Weight 694.64
MOL File 63721-83-5.mol
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Chemical Properties

Melting point  195 °C (dec.)(lit.)
pka pK2:2.58(-1);pK3:3.23(-2);pK4:6.37(-3);pK5: 10.46(-4);pK6: 12.28(-5) (25°C)
InChIKey VFKMJZUEFSTCGQ-PXNGTKLSSA-M
SMILES C(=C1/C=C(C(=O)C(CN(CC(=O)O)CC(=O)O)=C/1)C)(\C1=CC(=C(O)C(CN(CC(=O)O)CC(=O)O)=C1)C)/C1C=CC=CC=1S([O-])(=O)=O.[Na+]
CAS DataBase Reference 63721-83-5

Safety Data

Safety Statements 
WGK Germany  3
HS Code  2914.50.3000

Hazard Information

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