TCTU; 1-(Bis-dimethylamino-methylene)-5-chloro-3-oxy-1H-benzotriazol-1-ium Tetrafluoroborate

Basic Information

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CAS Number

330641-16-2

Molecular Formula

C11H15BClF4N5O

Molecular Weight

355.53 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 Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

201-205 ºC

Solubility

DMF: 10%, clear

SMILES

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[B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C2=C(C=CC(=C2)Cl)N=N1

InChI

InChI=1S/C11H15ClN5O.BF4/c1-15(2)11(16(3)4)18-17-10-7-8(12)5-6-9(10)13-14-17;2-1(3,4)5/h5-7H,1-4H3;/q+1;-1

InChIKey

GBGVQFJZGHBZMC-UHFFFAOYSA-N

LogP

2.00300

Complexity

338

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

2-(6-chloro-1H-benzo[d][1,2,3]triazol-1-yl)-1,1,3,3-tetramethylisouronium tetrafluoroborate
DTXSID50647863
AKOS030228498
N,N,N inverted exclamation marka,N inverted exclamation marka-Tetramethyl-O-(6-chloro-1H-benzotriazol-1-yl)uronium tetrafluoroborate
N,N,N',N'-Tetramethyl-O-(6-chloro-1H-benzotriazol-1-yl)uronium tetrafluoroborate
O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate, 98%
C1926
O-((1H)-6-Chlorobenzotriazole-1-yl)-1,1,3,3-tetramethyluronium tetrafluoroborate
AKOS015909768
[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylene]-dimethyl-ammonium tetrafluoroborate
O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate
O-(6-Chloro-1-hydrocibenzotriazol-1-yl)- -1,1,3,3-tetramethyluroniumTetrafluoroborate
O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborat e
AM83862
GBGVQFJZGHBZMC-UHFFFAOYSA-N
[(6-chloro-1-benzotriazolyl)oxy-(dimethylamino)methylidene]-dimethylammonium tetrafluoroborate
C11H15BClF4N5O
TCTU
[(6-Chloro-1H-benzotriazol-1-yl)oxy](dimethylamino)-N,N-dimethylmethaniminium tetrafluoroborate
[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylidene]-dimethylazanium;tetrafluoroborate
330641-16-2
FT-0644439
CS-W020829
1-[Bis(dimethylamino)methylen]-5-chlorobenzotriazolium 3-oxide tetrafluoroborate
AS-17364
A821598
TCTU; 1-(Bis-dimethylamino-methylene)-5-chloro-3-oxy-1H-benzotriazol-1-ium tetrafluoroborate
876593-69-0
SCHEMBL419612
AKOS015965056
[(6-chloranylbenzotriazol-1-yl)oxy-(dimethylamino)methylidene]-dimethyl-azanium tetrafluoroborate

MDL Number

MFCD08461912

FAQ

What regulatory guidelines apply to TCTU (CAS: 330641-16-2)?

TCTU (CAS: 330641-16-2) is subject to various regulatory guidelines. It falls under the classification of a hazardous substance under the GHS (Globally Harmonized System of Classification and Labelling of Chemicals). Specific requirements include proper labelling, storage, and handling procedures. Additionally, REACH regulations require manufacturers and importers to register TCTU if it is produced or imported in quantities over one tonne per year. FDA and EPA guidelines also apply, particularly for its use in pharmaceuticals and environmental applications.

Are there alternatives to TCTU (CAS: 330641-16-2) in synthesis?

There are several alternatives to TCTU (CAS: 330641-16-2) that can be used in synthesis, depending on the specific needs of the reaction. Some common alternatives include triphenylphosphine oxide, 1,3-dicyclohexylcarbodiimide (DCC), and other azole derivatives. These alternatives may offer similar functionality but differ in reactivity and compatibility with other reagents.

What is the market or research trend for TCTU (CAS: 330641-16-2)?

The market for TCTU (CAS: 330641-16-2) is showing steady growth due to its applications in the synthesis of various pharmaceuticals and materials. Research trends indicate increasing interest in its use as a coupling agent in organic synthesis. The trend is also towards developing safer and more environmentally friendly alternatives, reflecting a broader shift in the chemical industry towards sustainability and regulatory compliance.

How should waste containing TCTU (CAS: 330641-16-2) be handled?

Waste containing TCTU (CAS: 330641-16-2) should be disposed of according to strict environmental and safety regulations. Proper waste collection methods should be employed, and the waste should be neutralized before disposal. Incineration is one common method, but it must be done in a controlled environment to prevent the release of harmful substances. Alternatively, professional waste disposal services can handle the waste safely, ensuring compliance with regulatory standards and minimizing environmental impact.