7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (1:1:1)

Basic Information

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CAS Number

122965-43-9

Molecular Formula

C16H20ClN3OS

Molecular Weight

337.9 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

100-110 ºC

Water Solubility

Soluble in water, alcohol, acetic acid, glycerol and chloroform. Insoluble in ether.

Solubility

H2O: soluble4mg/4ml

SMILES

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CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.O.[Cl-]

InChI

InChI=1S/C16H18N3S.ClH.H2O/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13;;/h5-10H,1-4H3;1H;1H2/q+1;;/p-1

InChIKey

WQVSELLRAGBDLX-UHFFFAOYSA-M

LogP

-0.56140

Complexity

483

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

Phenothiazin-5-ium, 3,7-bis(dimethylamino)-, chloride, hydrate
C.I 52015
FT-0775246
Methylene Blue (hydrate)
Methylene blue, certified by the Biological Stain Commission
E79163
AS-80058
3,7-Bis(dimethylamino)phenothiazin-5-ium chloride xhydrate
XEA96543
Zinc free Methylene Blue
Basic Blue 9 monohydrate
C.i. basic Blue 9 monohydrate
Methylthioninium chloride, European Pharmacopoeia (EP) Reference Standard
AKOS027257255
Methylthioninium chloride hydrate (JAN)
N-(7-(dimethylamino)-3H-phenothiazin-3-ylidene)-N-methylmethanaminium chloride hydrate
A890868
3,7-Bis(dimethylamino)phenothiazin-5-ium chloride hydrate(1:1:x)
Methylene blue (TN)
[7-(dimethylamino)phenothiazin-3-ylidene]-dimethylazanium;chloride;hydrate
2-Isopropylpiperidin-4-one?HCl
122965-43-9
D10537
UNII-O3YJW1TB3C
3,7-Bis(dimethylamino)phenothiazin-5-ium chloride hydrate
AKOS015910302
Phenothiazin-5-ium, 3,7-bis(dimethylamino)-, chloride, monohydrate
Methylene Blue hydrate, suitable for nucleic acid staining, BioReagent
Methylene Blue zinc chloride double salt, for microscopy (Bact., Bot., Hist.), ~1 mol/mol water
SCHEMBL1535732
Phenothiazin-5-ium, 3,7-bis(dimethylamino)-, chloride, hydrate (1:1:1)

MDL Number

MFCD00012111

FAQ

What regulatory guidelines apply to 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9)?

7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9) should comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazardous chemicals. It is also subject to REACH regulations in the European Union, requiring registration and assessment of its safety. In the United States, it is regulated by the FDA for pharmaceutical use and by the EPA for environmental safety.

Are there alternatives to 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9) in synthesis?

Yes, there are several alternatives to 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9) in synthesis, such as other phenothiazine derivatives like 4-(Dimethylamino)phenothiazine and 2-methylphenothiazine, which can be used as substitutes depending on the specific requirements of the reaction.

What is the market or research trend for 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9)?

The market for 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9) is driven by its use in pharmaceutical and cosmetic industries. Recent research trends focus on its potential applications in anti-inflammatory, antipsychotic, and skin care products. Additionally, studies on its environmental impact and biodegradability are also emerging, reflecting growing concerns in sustainable chemistry.

How should waste containing 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9) be handled?

Waste containing 7-(Dimethylamino)-N,N-dimethyl-3H-phenothiazin-3-iminium chloride hydrate (CAS: 122965-43-9) should be collected and treated in accordance with local and national regulations. It is recommended to neutralize any acidic components and ensure the waste is securely sealed before disposal. Incineration or professional waste disposal services should be used to minimize environmental impact, and appropriate safety measures should be taken to prevent contamination during handling and transportation.