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Phenolate, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[5-methyl-2-(1-methylethyl)-, sodium salt (1:1)(CAS: 62625-21-2)

Phenolate, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[5-methyl-2-(1-methylethyl)-, sodium salt (1:1)
CAS Number

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Basic Information

Molecular Formula
C27H28NaO5S
Molecular Weight
488.6 g/mol

Physical Properties

Melting Point
283-285 °C (dec.)(lit.)
Density
0.979 g/mL at 25 °C
Water Solubility
Soluble in waterSoluble in 0.1N hydrochloric acid/ethanol.

Chemical Identifiers

SMILES
CC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)[O-])C(C)C)C(C)C)O.[Na+]
InChIKey
BAVBEHWEOJMHDS-UHFFFAOYSA-L

Database References

MDL Number
MFCD00151093
Beilstein Registry Number
3861515

FAQ

Phenolate, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[5-methyl-2-(1-methylethyl)-, sodium salt (1:1) is a complex organic compound with a molecular structure derived from a benzoxathiol derivative. It is used in various applications including pharmaceuticals, chemical synthesis, and research.
This compound is used primarily in pharmaceutical research, as a precursor for organic synthesis, and in certain chemical applications. It may also find uses in the food industry as a flavoring agent.
The safety of this compound depends on the context of use. It should be handled with caution as it is a reactive compound. Protective measures include wearing appropriate personal protective equipment and ensuring proper ventilation. Ingestion or contact with the skin should be avoided.
This compound should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation. Ideal storage conditions include a temperature range of 15-25°C and a relative humidity of less than 60%.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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