ChemicalBook > CAS DataBase List > 2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE

2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE

Product Name
2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE
CAS No.
106086-78-6
Chemical Name
2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE
Synonyms
2-BroMoMethyl benzothizaole;2-(BROMOMETHYL)BENZOTHIAZOLE;Benzothiazole,2-(broMoMethyl)-;2-(bromomethyl)benzo[d]thiazole;2-(Bromomethyl)-1,3-benzothiazol;2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE;2-(Bromomethyl)benzothiazole, 98+%;[(Benzo[d]thiazol-2-yl)methyl]bromide;2-(Bromomethyl)-1,3-benzothiazole ,95%
CBNumber
CB2225922
Molecular Formula
C8H6BrNS
Formula Weight
228.11
MOL File
106086-78-6.mol
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2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE Property

Melting point:
47 °C
Boiling point:
288℃
Density 
1.680
Flash point:
128℃
storage temp. 
Inert atmosphere,2-8°C
pka
0.38±0.10(Predicted)
form 
crystalline powder
color 
Pale yellow
CAS DataBase Reference
106086-78-6(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi,C,Xn
Risk Statements 
34-41-37/38-22
Safety Statements 
26-36/37/39-36/37/3945-39
RIDADR 
3261
Hazard Note 
Irritant
HazardClass 
8
PackingGroup 
III
HS Code 
2934208090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H302Harmful if swallowed

H314Causes severe skin burns and eye damage

H315Causes skin irritation

H318Causes serious eye damage

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P301+P330+P331IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

TCI Chemical
Product number
B6226
Product name
2-(Bromomethyl)-1,3-benzothiazole
Purity
min. 98.0 %
Packaging
1G
Price
$108
Updated
2025/07/31
TCI Chemical
Product number
B6226
Product name
2-(Bromomethyl)-1,3-benzothiazole
Purity
min. 98.0 %
Packaging
5G
Price
$429
Updated
2025/07/31
TRC
Product number
B697078
Product name
2-(Bromomethyl)-1,3-benzothiazole
Packaging
250mg
Price
$55
Updated
2021/12/16
Apolloscientific
Product number
OR23090
Product name
2-(Bromomethyl)-1,3-benzothiazole
Packaging
100mg
Price
$17
Updated
2021/12/16
SynQuest Laboratories
Product number
7H70-9-X7
Product name
2-(Bromomethyl)-1,3-benzothiazole
Packaging
100mg
Price
$20
Updated
2021/12/16
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2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE Chemical Properties,Usage,Production

Synthesis

37859-42-0

106086-78-6

The general procedure for the synthesis of 2-(bromomethyl)benzothiazole using 2-hydroxymethylbenzothiazole as starting material was as follows: 2-hydroxymethylbenzothiazole (1.00 g, 6.05 mmol) was dissolved in an appropriate amount of CH2Cl2 according to Attardo's method 1. Phosphorus tribromide (1.15 mL, 12.1 mmol) was slowly added dropwise to the above solution under argon protection. The reaction mixture was stirred at room temperature for 2 hours. Upon completion of the reaction, the solvent was removed by distillation under reduced pressure. The resulting crude product was purified by silica gel column chromatography (eluent ratio hexane:ethyl acetate = 5:1) to afford 2-(bromomethyl)benzothiazole (786 mg, 57% yield) as a brown solid. The structure of the product was confirmed by the following characterization data: 1H NMR (300 MHz, CDCl3) δ 4.81 (s, 2H), 7.42 (td, 1H, J = 8.1 Hz, 1.1 Hz), 7.50 (td, 1H, J = 8.1 Hz, 1.1 Hz), 7.87 (dd, 1H, J = 8.1 Hz, 1.1 Hz), 8.02 ( dd, 1H, J = 8.1 Hz, 1.1 Hz); 13C NMR (75 MHz, CDCl3) δ 27.1, 121.8, 123.5, 125.9, 126.5, 136.2, 152.8, 166.2; mass spectrometry (EI) showed molecular ion peaks at m/z 227, 229 (M+); and thin-layer chromatography (TLC) showed Rf value of 0.60 (unfolding agent ratio of hexane:ethyl acetate=5:1).

References

[1] Bioorganic and Medicinal Chemistry Letters, 2016, vol. 26, # 1, p. 43 - 45
[2] Patent: WO2017/66606, 2017, A1. Location in patent: Page/Page column 95; 96
[3] Journal of the American Chemical Society, 2017, vol. 139, # 21, p. 7318 - 7334
[4] Patent: WO2018/191394, 2018, A1. Location in patent: Page/Page column 135-136
[5] Zhurnal Obshchei Khimii, 1951, vol. 21, p. 2055,2056, 2061; engl. Ausg. S. 2295, 2301

2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE manufacturers

Career Henan Chemical Co
Product
5-BROMO-2,1,3-BENZOTHIADIAZOLE 106086-78-6
Price
US $2.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
customise
Release date
2018-08-09

106086-78-6, 2-(BROMOMETHYL)-1,3-BENZOTHIAZOLERelated Search:


  • 2-(BROMOMETHYL)BENZOTHIAZOLE
  • 2-(BROMOMETHYL)-1,3-BENZOTHIAZOLE
  • 2-(Bromomethyl)benzothiazole, 98+%
  • 2-(bromomethyl)benzo[d]thiazole
  • 2-(Bromomethyl)-1,3-benzothiazole ,95%
  • Benzothiazole,2-(broMoMethyl)-
  • 2-BroMoMethyl benzothizaole
  • [(Benzo[d]thiazol-2-yl)methyl]bromide
  • 2-(Bromomethyl)-1,3-benzothiazol
  • 106086-78-6
  • C8H6BrNS
  • ALKYL HALIDE