Xylenol Orange sodium salt

Modify Date: 2024-01-05 23:35:55

Xylenol Orange sodium salt Structure
Xylenol Orange sodium salt structure
Common Name Xylenol Orange sodium salt
CAS Number 63721-83-5 Molecular Weight 694.638
Density N/A Boiling Point N/A
Molecular Formula C31H31N2NaO13S Melting Point 209-211ºC
MSDS N/A Flash Point N/A

 Names

Name Xylenol Orange Sodium Salt
Synonym More Synonyms

 Chemical & Physical Properties

Melting Point 209-211ºC
Molecular Formula C31H31N2NaO13S
Molecular Weight 694.638
Exact Mass 694.144470
PSA 258.56000
LogP 2.38520
InChIKey VFKMJZUEFSTCGQ-PXNGTKLSSA-M
SMILES CC1=CC(=C(c2cc(C)c(O)c(CN(CC(=O)O)CC(=O)O)c2)c2ccccc2S(=O)(=O)[O-])C=C(CN(CC(=O)O)CC(=O)O)C1=O.[Na+]

 Safety Information

Hazard Codes Xi
Safety Phrases S22-S24/25
WGK Germany 3

 Synonyms

Xylenol Orange sodium salt
MFCD00011493
EINECS 216-553-8
Sodium 2-[(E)-(3-{[bis(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)(3-{[bis(carboxymethyl)amino]methyl}-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzenesulfonate
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