Einecs 305-335-9

Basic Information

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CAS Number

94442-10-1

Molecular Formula

C32H30N2Na2O12

Molecular Weight

658.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC1=CC(=CC(=C1O)CN(CC(=O)O)CC(=O)O)C(=C2C=C(C(=O)C(=C2)CN(CC(=O)O)CC(=O)O)C)C3=CC=CC=C3C(=O)[O-].[Na+]

InChI

InChI=1S/C32H32N2O12.2Na/c1-17-7-21(9-19(29(17)43)11-33(13-25(35)36)14-26(37)38)32(24-6-4-3-5-23(24)31(45)46-32)22-8-18(2)30(44)20(10-22)12-34(15-27(39)40)16-28(41)42;;/h3-10,43-44H,11-16H2,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42);;/q;2*+1/p-2

InChIKey

MFIVBKPWJUKFJV-UHFFFAOYSA-L

LogP

-0.55010

Complexity

1290

Synonyms & References

English

o-Cresolphthalein complexone disodium salt
Disodium dihydrogen N,N'-[(3-oxo-(3H)-isobenzofuran-1-ylidene)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[N-(carboxylatomethyl)glycinate]
sodium,2-[(Z)-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-[3-[[bis(carboxymethyl)amino]methyl]-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene]methyl]benzoate
Disodium dihydrogen N,N'-((3-oxo-(3H)-isobenzofuran-1-ylidene)bis((6-hydroxy-5-methyl-3,1-phenylene)methylene))bis(N-(carboxylatomethyl)glycinate)
EINECS 305-335-9
Glycine, N,N′-[(3-oxo-1(3H)-isobenzofuranylidene)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[N-(carboxymethyl)-, disodium salt (9CI)
SCHEMBL4950022
94442-10-1
sodium;2-[(Z)-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-[3-[[bis(carboxymethyl)amino]methyl]-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene]methyl]benzoate
NS00122676

MDL Number

MFCD00148977

FAQ

What regulatory guidelines apply to [compound name] (CAS: 94442-10-1)?

Regulatory guidelines for [compound name] (CAS: 94442-10-1) include GHS classification, which categorizes the compound under flammable liquids category 3. Additionally, REACH regulations require manufacturers and importers to conduct a safety assessment and register the substance if the annual tonnage exceeds the threshold. FDA and EPA regulations also apply, with specific guidelines on its use and disposal in the United States.

Are there alternatives to [compound name] (CAS: 94442-10-1) in synthesis?

Yes, there are alternatives to [compound name] (CAS: 94442-10-1) in synthesis. Common substitutes include isopropyl alcohol and ethanol, which are often used as solvents in similar reactions. Other analogs, such as tert-butanol, can also be considered based on the specific requirements of the synthesis process.

What is the market or research trend for [compound name] (CAS: 94442-10-1)?

The market trend for [compound name] (CAS: 94442-10-1) has been stable with increasing demand in the pharmaceutical and chemical industries. Research trends are focusing on its use in green chemistry and sustainable manufacturing processes. There is also growing interest in developing safer and more environmentally friendly alternatives, driven by regulatory pressures and sustainability goals.

How should waste containing [compound name] (CAS: 94442-10-1) be handled?

Waste containing [compound name] (CAS: 94442-10-1) should be collected in compatible containers and stored in a well-ventilated area. Proper incineration or professional waste disposal services should be employed. Environmental protection measures include ensuring no spillage and proper containment to prevent soil and water contamination. It is important to follow local regulations and guidelines for hazardous waste management.