2-[4-(Dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride

Basic Information

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CAS Number

2390-54-7

Molecular Formula

C17H19ClN2S

Molecular Weight

318.9 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

212

Boiling Point

°Cat760mmHg

Solubility

methanol: soluble1mg/mL

SMILES

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CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.[Cl-]

InChI

InChI=1S/C17H19N2S.ClH/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;/h5-11H,1-4H3;1H/q+1;/p-1

InChIKey

JADVWWSKYZXRGX-UHFFFAOYSA-M

LogP

0.77120

Complexity

325

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 6.1(b) Class 6.1(b)

Synonyms & References

English

2-[4-(dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride
A930157
Thioflavin TG
NSC 11235
Thioflavine T
AMY37135
CHEMBL224392
DTXSID10883841
CS-7552
Benzothiazolium, 2-(4-(dimethylamino)phenyl)-3,6-dimethyl-, chloride (1:1)
Basic Yellow T
Tannoflavine T
BP-30130
3,6-Dimethyl-2-dimethylaminophenylbenzothiazolium chloride
Brilliant Flavine T
CHEBI:76023
Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, chloride
C.I. 49005
NSC11235
SCHEMBL25298
1326-12-1
2-[4-(Dimethylamino)phenyl]-3,6-dimethylbenzo[d]thiazol-3-ium Chloride
Thioflavin T, used as stain for amyloid
Thioflavine
FT-0744526
Methylene Yellow N
Benzothiazolium, 2-(4-(dimethylamino)phenyl)-3,6-dimethyl-, chloride
C.I. Basic Yellow 1
ci 49005
Basic Yellow 1Basic Yellow 1
EINECS 219-228-9

MDL Number

MFCD00011944

Customs Code

32041300

FAQ

What is 2-[4-(Dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride (CAS: 2390-54-7)?

2-[4-(Dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride is a yellow or orange crystalline solid. It is a substituted benzothiazolium salt with potential applications in the pharmaceutical and research fields.

What are the main uses of 2-[4-(Dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride (CAS: 2390-54-7)?

The compound is used in pharmaceutical research as a chromophore and in the synthesis of other organic compounds. It can also serve as a fluorescent dye in various analytical applications.

Is 2-[4-(Dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride (CAS: 2390-54-7) safe?

The compound is generally considered safe for laboratory use, but proper handling precautions are necessary. It should be stored away from moisture and handled with gloves. In case of contact, rinse with water immediately and seek medical advice.

How should 2-[4-(Dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride (CAS: 2390-54-7) be stored?

Store the compound in a cool, dry place, away from direct sunlight. Keep it in a tightly sealed container to prevent moisture absorption. Maintain a temperature of 15-25°C and a relative humidity below 60%. Avoid contact with oxidizing agents and strong acids.