ChemicalBook--->CAS DataBase List--->74385-09-4

74385-09-4

74385-09-4 Structure

74385-09-4 Structure
IdentificationBack Directory
[Name]

3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE
[CAS]

74385-09-4
[Synonyms]

N-CARBOXYMETHYLBENZOTHIAZOLIUM BROMIDE
3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE
3-(Carboxymethyl)benzothiazolium Bromide >
3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE 97+%
3-(Carboxymethyl)benzo[d]thiazol-3-ium bromide
2-(1,3-benzothiazol-3-ium-3-yl)acetic acid:bromide
2-(Benzo[d]thiazol-3-ium-3-yl)acetate hydrobromide
[Molecular Formula]

C9H8BrNO2S
[MDL Number]

MFCD00134360
[MOL File]

74385-09-4.mol
[Molecular Weight]

274.13
Chemical PropertiesBack Directory
[Melting point ]

250 °C (dec.)(lit.)
[form ]

solid
[InChI]

1S/C9H7NO2S.BrH/c11-9(12)5-10-6-13-8-4-2-1-3-7(8)10;/h1-4,6H,5H2;1H
[InChIKey]

UEINBJHBQWSAHA-UHFFFAOYSA-N
[SMILES]

[Br-].OC(=O)C[n+]1csc2ccccc12
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-37/39
[WGK Germany ]

3
[Storage Class]

13 - Non Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

3-(Carboxymethyl)benzothiazolium bromide may be used in the synthesis of novel semisquarylium dye, via reaction with 3,4-dibutoxy-3-cyclobutene-1,2-dione.
[General Description]

3-(Carboxymethyl)benzothiazolium bromide, a halogenated building block, is a thiazole derivative.3-(Carboxymethyl)benzothiazolium bromide (3-(carboxymethyl)-2-methylbenzothiazolium bromide) is a benzothiazolium salt. Synthesis of 3-(carboxymethyl)benzothiazolium bromide has been reported. It can be prepared by reacting 2-methylbenzothiazole with bromoacetic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE(74385-09-4)1HNMR
3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE(74385-09-4)13CNMR
3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE(74385-09-4)IR1
3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE(74385-09-4)IR2
3-(CARBOXYMETHYL)BENZOTHIAZOLIUM BROMIDE(74385-09-4)Raman
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