2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate | CAS No. 68238-36-8

2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate

Basic Information

CAS Number

68238-36-8

Molecular Formula

C27H31N2O6S2

Molecular Weight

566.7 g/mol

AD

Basic Physical Properties

CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C27H32N2O6S2/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-19-24(36(30,31)32)17-18-26(25)37(33,34)35/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35)/p-1

InChIKey

YFKDCGWIINMRQY-UHFFFAOYSA-M

LogP

6.21260

Complexity

1040

Synonyms & References

English

  • Sulfanblau
  • D04634
  • 2,5-Disulfophenyl isomer
  • SULPHAN BLUE 2,5-DISULFOPHENYL ISOMER [MI]
  • SCHEMBL3324345
  • ISOSULFAN BLUE [WHO-DD]
  • 68238-36-8
  • (4-(alpha-(p-(Diethylamino)phenyl)-2,5-disulfobenzylidene)-2,5-cyclohexadien-1-ylidene)diethylammonium hydroxide, inner salt, sodium salt
  • AKOS015904521
  • Lymphazurin (TN)
  • CAS-68238-36-8
  • LYMPHAZURIN
  • HSDB 8071
  • DTXSID8057805
  • MFCD00867653
  • Ethanaminium, N-(4-((4-(diethylamino)phenyl)(2,5-disulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, hydroxide, inner salt, sodium salt
  • Sulphan blue 2,5-disulfophenyl isomer
  • Sodium 2-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)benzene-1,4-disulfonate
  • Isosulfan blue [USAN]
  • Patent blau V
  • ETHANAMINIUM, N-(4-((4-(DIETHYLAMINO)PHENYL)(2,5-DISULFOPHENYL)METHYLENE)-2,5-CYCLOHEXADIEN-1-YLIDENE)-N-ETHYL-, INNER SALT, SODIUM SALT
  • CHEMBL1200859
  • Tox21_113733
  • SODIUM 2-((4-(DIETHYLAMINO)PHENYL)(4-(DIETHYLIMINIO)CYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL)BENZENE-1,4-DISULPHONATE
  • ISOSULFAN BLUE [ORANGE BOOK]
  • ISOSULFAN BLUE
  • sodium;2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate
  • P 1888
  • (4-(.ALPHA.-(P-(DIETHYLAMINO)PHENYL)-2,5-DISULFOBENZYLIDENE)-2,5-CYCLOHEXADIEN-1-YLIDENE)DIETHYLAMMONIUM HYDROXIDE, INNER SALT, SODIUM SALT
  • P-1888
  • Isosulfan blue (USAN)

MDL Number

MFCD00867653

FAQ

What regulatory guidelines apply to 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8)?

The compound 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8) is subject to various regulatory guidelines under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations, and FDA/EPA requirements. It must be evaluated for its health and environmental hazards, and proper reporting and documentation are required during its manufacture, import, and use. Compliance with local safety data sheets (SDS) and material safety data sheets (MSDS) is essential.

Are there alternatives to 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8) in synthesis?

While 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8) is a specific compound, there are alternative reagents and synthetic pathways that can be used to achieve similar functionalities. These alternatives often include other sulfonates or diethylated derivatives. It is important to consider the specific application and the availability of these alternatives in terms of cost and feasibility.

What is the market or research trend for 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8)?

The market for 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8) is currently focused on its use in specialized chemical applications, such as pharmaceuticals and fine chemicals. Research trends indicate increasing interest in its potential for therapeutic applications and as a precursor in the synthesis of other compounds. However, due to its specialized nature, market demand is relatively niche and research is ongoing to explore new applications.

How should waste containing 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8) be handled?

Handling waste containing 2-{[4-(Diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-1,4-benzenedisulfonate (CAS: 68238-36-8) requires adherence to environmental protection standards and local regulations. Waste should be collected in appropriate containers and sealed to prevent spillage. Incineration is a common disposal method, but professional waste disposal services should be utilized to ensure compliance with safety and environmental regulations. Additionally, proper neutralization and packaging are necessary to minimize environmental impact.

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