4,4'-{[4-(Methylimino)-2,5-cyclohexadien-1-ylidene]methylene}bis(N,N-dimethylaniline) hydrochloride (1:1)

Basic Information

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CAS Number

8004-87-3

Molecular Formula

C24H28ClN3

Molecular Weight

397.98 g/mol

Basic Physical Properties

Melting Point

137°C

Boiling Point

548.19°C (rough estimate)

Density

1.0395 (rough estimate)

Water Solubility

soluble

Flash Point

70ºC

Refractive Index

1.6010 (estimate)

SMILES

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CNc1ccc(cc1)C(=C1CCC(=[N+](C)C)CC1)c1ccc(cc1)N(C)C.[Cl-]

InChI

InChI=1S/C24H27N3.ClH/c1-25-21-12-6-18(7-13-21)24(19-8-14-22(15-9-19)26(2)3)20-10-16-23(17-11-20)27(4)5;/h6-17H,1-5H3;1H

InChIKey

JFTBTTPUYRGXDG-UHFFFAOYSA-N

LogP

5.61930

Complexity

560

Safety Information

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GHS Hazard Pictograms

H302

H400

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H400 Very toxic to aquatic life
Hazardous to the aquatic environment, acute hazard

Hazard Class

Class 9 Class 9

Stability

吸湿性

Sensitiveness

对光敏感

Synonyms & References

English

[4-[(4-Dimethylaminophenyl)-(4-methylaminophenyl)methylidene]-1-cyclohexa-2,5-dienylidene]-dimethyl-azanium
Methyl Violet 2B, dye content ca 75%
Methyl Violet 2B,pure,indicator grade
Methyl Violet 2B,pure,high purity biologicalstain
Methyl Violet 2B,pure,certified
Methyl violet 2B 1g [8004-87-3]
PyrokataniuM blue
Aniline Violet Dahlia Violet B Methyl Violet
Methyl Violet 2B
Basic Violet 1
C.I. 42535
Methyl Violet
[4-[[4-(dimethylamino)phenyl]-[4-(methylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium,chloride
METHYL VIOLET, C.I. 42535 FOR MICROSCOPY
C.I. NO. 42535
Dahlia B
IND(pH 0.1-2.0)
Kristallviolett
Methyl Violet 2B, certified, pure
Methyl Violet 2B, pure, certified
Aniline Violet
Dahlia Violet B
Methyl Violet B base
Solvent Violet 8
Pentamethylpararosaniline
C.I. Solvent Violet 8
Pigment Violet 3
B4JIJ2C6AT
LIGHT FAST VIOLET LAKE
Aniline, 4,4'-((4-(methylimino)-2,5-cyclohexadien-1-ylidene)methylene)bis(N,N-dimethyl-
4,4'-((4-(Methylimino)-2,5-cyclohexadien-1-ylidene)methylene)bis(N,N-dimethylaniline)

MDL Number

MFCD00012568

Customs Code

32041300

FAQ

What is 4,4'-{[4-(Methylimino)-2,5-cyclohexadien-1-ylidene]methylene}bis(N,N-dimethylaniline) hydrochloride (1:1) (CAS: 8004-87-3)?

4,4'-{[4-(Methylimino)-2,5-cyclohexadien-1-ylidene]methylene}bis(N,N-dimethylaniline) hydrochloride (1:1), with CAS number 8004-87-3, is a chemical compound used primarily as a dye intermediate. It exhibits aromatic properties and is characterized by its bis-aniline structure, forming a hydrochloride salt with a 1:1 ratio of HCl. The compound is known for its stability in organic synthesis.

What are the main uses of 4,4'-{[4-(Methylimino)-2,5-cyclohexadien-1-ylidene]methylene}bis(N,N-dimethylaniline) hydrochloride (1:1) (CAS: 8004-87-3)?

This compound is widely utilized in pharmaceuticals for synthesizing bioactive molecules and as an intermediate in dye production. It also finds applications in industrial chemistry for creating specialty chemicals and in research for functional group manipulations. Its unique structure makes it valuable in developing new materials and compounds.

Is 4,4'-{[4-(Methylimino)-2,5-cyclohexadien-1-ylidene]methylene}bis(N,N-dimethylaniline) hydrochloride (1:1) (CAS: 8004-87-3) safe?

Safety precautions are necessary when handling this compound. It may cause skin and eye irritation, and inhalation of its vapors could be harmful. Proper PPE, including gloves and goggles, is recommended. While it is generally considered safe in controlled environments, adherence to OSHA guidelines and MSDS recommendations is critical to minimize risks.

How should 4,4'-{[4-(Methylimino)-2,5-cyclohexadien-1-ylidene]methylene}bis(N,N-dimethylaniline) hydrochloride (1:1) (CAS: 8004-87-3) be stored?

Store this compound in a cool, dry place at 25°C, away from light and moisture. Use airtight containers to maintain stability and prevent degradation. Avoid exposure to humid environments to ensure long-term preservation. Proper storage conditions are essential to maintain its chemical integrity and safety.